3-[(2,4-Dichlorobenzylidene)amino]-6H-dibenzo[b,d]pyran-6-one (Q27148549)

3-[(2,4-dichlorobenzylidene)amino]-6h-dibenzo[b,d]pyran-6-one (English)

8 October 2016

chemical formula

C₂₀H₁₁Cl₂NO₂

0 references

canonical SMILES

C1=CC=C2C(=C1)C=3C=CC(=CC3OC2=O)N=C(C=4C=CC(=CC4Cl)Cl)[H]

1 reference

3-[(2,4-Dichlorobenzylidene)amino]-6H-dibenzo[b,d]pyran-6-one (English)

8 October 2016

isomeric SMILES

C1=CC=C2C(=C1)C=3C=CC(=CC3OC2=O)/N=C(/C=4C=CC(=CC4Cl)Cl)\[H]

1 reference

3-[(2,4-Dichlorobenzylidene)amino]-6H-dibenzo[b,d]pyran-6-one (English)

InChI=1S/C20H11Cl2NO2/c21-13-6-5-12(18(22)9-13)11-23-14-7-8-16-15-3-1-2-4-17(15)20(24)25-19(16)10-14/h1-11H/b23-11+

8 October 2016

Identifiers

InChI

1 reference

3-[(2,4-Dichlorobenzylidene)amino]-6H-dibenzo[b,d]pyran-6-one (English)

LHPIPCCMOMTVQL-FOKLQQMPSA-N

8 October 2016

InChIKey

2 references

3-[(2,4-Dichlorobenzylidene)amino]-6H-dibenzo[b,d]pyran-6-one (English)

8 October 2016

stated in

ChEBI release 2020-09-01

0 references

1 reference

3-[(2,4-dichlorobenzylidene)amino]-6h-dibenzo[b,d]pyran-6-one (English)

8 October 2016

ChEBI ID

79474

mapping relation type

2 references

3-[(2,4-Dichlorobenzylidene)amino]-6H-dibenzo[b,d]pyran-6-one (English)

matched by identifier from

8 October 2016

International Chemical Identifier

InChI

InChI=1S/C20H11Cl2NO2/c21-13-6-5-12(18(22)9-13)11-23-14-7-8-16-15-3-1-2-4-17(15)20(24)25-19(16)10-14/h1-11H/b23-11+

DSSTox substance ID

DTXSID50290353

2 references

stated in

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

matched by identifier from

InChIKey

LHPIPCCMOMTVQL-FOKLQQMPSA-N

DSSTOX compound identifier

0 references

0 references

1 reference

3-[(2,4-Dichlorobenzylidene)amino]-6H-dibenzo[b,d]pyran-6-one (English)