2-[4-[[(3-chlorophenyl)-oxomethyl]amino]phenyl]propanedioic acid dimethyl ester (Q27183771)

dimethyl 2-{4-[(3-chlorobenzoyl)amino]phenyl}malonate (English)

10 October 2016

chemical formula

C₁₈H₁₆ClNO₅

1 reference

dimethyl 2-{4-[(3-chlorobenzoyl)amino]phenyl}malonate (English)

10 October 2016

canonical SMILES

COC(=O)C(C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)Cl)C(=O)OC

1 reference

dimethyl 2-{4-[(3-chlorobenzoyl)amino]phenyl}malonate (English)

InChI=1S/C18H16ClNO5/c1-24-17(22)15(18(23)25-2)11-6-8-14(9-7-11)20-16(21)12-4-3-5-13(19)10-12/h3-10,15H,1-2H3,(H,20,21)

10 October 2016

Identifiers

InChI

1 reference

dimethyl 2-{4-[(3-chlorobenzoyl)amino]phenyl}malonate (English)

HUINXFWINSOUFT-UHFFFAOYSA-N

10 October 2016

InChIKey

2 references

dimethyl 2-{4-[(3-chlorobenzoyl)amino]phenyl}malonate (English)

10 October 2016

stated in

ChEBI release 2020-09-01

1 reference

Dimethyl {4-[(3-chlorobenzoyl)amino]phenyl}malonate (English)

10 October 2016

1 reference

dimethyl 2-{4-[(3-chlorobenzoyl)amino]phenyl}malonate (English)

10 October 2016

ChEBI ID

105977

mapping relation type

1 reference

2-[4-[[(3-chlorophenyl)-oxomethyl]amino]phenyl]propanedioic acid dimethyl ester (English)

10 October 2016

1 reference