icotinib hydrochloride (Q27281690)

Icotinib Hydrochloride (English)

14 October 2016

chemical formula

C₂₂H₂₂ClN₃O₄

1 reference

Icotinib Hydrochloride (English)

14 October 2016

canonical SMILES

C#CC1=CC(=CC=C1)NC2=NC=NC3=CC4=C(C=C32)OCCOCCOCCO4.Cl

1 reference

Icotinib Hydrochloride (English)

InChI=1S/C22H21N3O4.ClH/c1-2-16-4-3-5-17(12-16)25-22-18-13-20-21(14-19(18)23-15-24-22)29-11-9-27-7-6-26-8-10-28-20;/h1,3-5,12-15H,6-11H2,(H,23,24,25);1H

14 October 2016

Identifiers

InChI

1 reference

Icotinib Hydrochloride (English)

14 October 2016

1 reference

Global Substance Registration System

Icotinib Hydrochloride (English)

14 October 2016

1 reference

UNII

JTD32I0J83

icotinib hydrochloride (English)

14 October 2016

1 reference

N-(3-Ethynylphenyl)-7,8,10,11,13,14-hexahydro[1,4,7,10]tetraoxacyclododecino[2,3-g]quinazolin-4-amine hydrochloride (1:1) (English)

14 October 2016

2 references

Icotinib Hydrochloride (English)

14 October 2016

ChEBI ID

201450

mapping relation type

exact match

1 reference

International Chemical Identifier

InChI

InChI=1S/C22H21N3O4.ClH/c1-2-16-4-3-5-17(12-16)25-22-18-13-20-21(14-19(18)23-15-24-22)29-11-9-27-7-6-26-8-10-28-20;/h1,3-5,12-15H,6-11H2,(H,23,24,25);1H

1 reference

2 references

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

DSSTOX compound identifier

0 references

2 references

Global Substance Registration System

UNII

JTD32I0J83

icotinib hydrochloride (English)

14 October 2016