3-[(3-chloranyl-4-methoxy-phenyl)amino]-2-(5-methylpyridin-2-yl)-3H-isoindol-1-one

Systemtic Name: 3-[(3-chloranyl-4-methoxy-phenyl)amino]-2-(5-methylpyridin-2-yl)-3H-isoindol-1-one Openeye Name: 3-(3-chloro-4-methoxy-anilino)-2-(5-methyl-2-pyridyl)isoindolin-1-one CAS Name: 3-(3-chloro-4-methoxyanilino)-2-(5-methyl-2-pyridinyl)-3H-isoindol-1-one IUPAC Name: 3-(3-chloro-4-methoxyanilino)-2-(5-methylpyridin-2-yl)-3H-isoindol-1-one Traditional Name: 3-(3-chloro-4-methoxy-anilino)-2-(5-methyl-2-pyridyl)isoindolin-1-one Formula: C21H18ClN3O2 MolecularWeight: 379.83952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)N2C(C3=CC=CC=C3C2=O)NC4=CC(=C(C=C4)OC)Cl

Isomeric SMILES

CC1=CN=C(C=C1)N2C(C3=CC=CC=C3C2=O)NC4=CC(=C(C=C4)OC)Cl

InChI

InChI=1S/C21H18ClN3O2/c1-13-7-10-19(23-12-13)25-20(15-5-3-4-6-16(15)21(25)26)24-14-8-9-18(27-2)17(22)11-14/h3-12,20,24H,1-2H3