N-[(3-chlorophenyl)methyl]-2-(3-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-2-(3-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-[(3-chlorophenyl)methyl]-2-(3-methoxyphenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: N-[(3-chlorophenyl)methyl]-2-(3-methoxyphenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-[(3-chlorophenyl)methyl]-2-(3-methoxyphenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: N-(3-chlorobenzyl)-1-keto-2-(3-methoxyphenyl)isoquinoline-4-carboxamide Formula: C24H19ClN2O3 MolecularWeight: 418.87226

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)NCC4=CC(=CC=C4)Cl

Isomeric SMILES

COC1=CC=CC(=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)NCC4=CC(=CC=C4)Cl

InChI

InChI=1S/C24H19ClN2O3/c1-30-19-9-5-8-18(13-19)27-15-22(20-10-2-3-11-21(20)24(27)29)23(28)26-14-16-6-4-7-17(25)12-16/h2-13,15H,14H2,1H3,(H,26,28)