2-(5-chloranylpyridin-2-yl)-3-[(2,5-dimethoxyphenyl)amino]-3H-isoindol-1-one

Systemtic Name: 2-(5-chloranylpyridin-2-yl)-3-[(2,5-dimethoxyphenyl)amino]-3H-isoindol-1-one Openeye Name: 2-(5-chloro-2-pyridyl)-3-(2,5-dimethoxyanilino)isoindolin-1-one CAS Name: 2-(5-chloro-2-pyridinyl)-3-(2,5-dimethoxyanilino)-3H-isoindol-1-one IUPAC Name: 2-(5-chloropyridin-2-yl)-3-(2,5-dimethoxyanilino)-3H-isoindol-1-one Traditional Name: 2-(5-chloro-2-pyridyl)-3-(2,5-dimethoxyanilino)isoindolin-1-one Formula: C21H18ClN3O3 MolecularWeight: 395.83892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC2C3=CC=CC=C3C(=O)N2C4=NC=C(C=C4)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC2C3=CC=CC=C3C(=O)N2C4=NC=C(C=C4)Cl

InChI

InChI=1S/C21H18ClN3O3/c1-27-14-8-9-18(28-2)17(11-14)24-20-15-5-3-4-6-16(15)21(26)25(20)19-10-7-13(22)12-23-19/h3-12,20,24H,1-2H3