N-(2-methoxy-5-methyl-phenyl)-2-(4-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-(2-methoxy-5-methyl-phenyl)-2-(4-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-(2-methoxy-5-methyl-phenyl)-2-(4-methoxyphenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: N-(2-methoxy-5-methylphenyl)-2-(4-methoxyphenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-(2-methoxy-5-methylphenyl)-2-(4-methoxyphenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: 1-keto-N-(2-methoxy-5-methyl-phenyl)-2-(4-methoxyphenyl)isoquinoline-4-carboxamide Formula: C25H22N2O4 MolecularWeight: 414.45318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H22N2O4/c1-16-8-13-23(31-3)22(14-16)26-24(28)21-15-27(17-9-11-18(30-2)12-10-17)25(29)20-7-5-4-6-19(20)21/h4-15H,1-3H3,(H,26,28)