6-chloranyl-N-[(4-methoxyphenyl)methyl]-2-methyl-4-(2-methylphenyl)-1-oxidanylidene-isoquinoline-3-carboxamide

Systemtic Name: 6-chloranyl-N-[(4-methoxyphenyl)methyl]-2-methyl-4-(2-methylphenyl)-1-oxidanylidene-isoquinoline-3-carboxamide Openeye Name: 6-chloro-N-[(4-methoxyphenyl)methyl]-2-methyl-4-(o-tolyl)-1-oxo-isoquinoline-3-carboxamide CAS Name: 6-chloro-N-[(4-methoxyphenyl)methyl]-2-methyl-4-(2-methylphenyl)-1-oxo-3-isoquinolinecarboxamide IUPAC Name: 6-chloro-N-[(4-methoxyphenyl)methyl]-2-methyl-4-(2-methylphenyl)-1-oxoisoquinoline-3-carboxamide Traditional Name: 6-chloro-1-keto-2-methyl-4-(o-tolyl)-N-p-anisyl-isoquinoline-3-carboxamide Formula: C26H23ClN2O3 MolecularWeight: 446.92542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(N(C(=O)C3=C2C=C(C=C3)Cl)C)C(=O)NCC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=CC=C1C2=C(N(C(=O)C3=C2C=C(C=C3)Cl)C)C(=O)NCC4=CC=C(C=C4)OC

InChI

InChI=1S/C26H23ClN2O3/c1-16-6-4-5-7-20(16)23-22-14-18(27)10-13-21(22)26(31)29(2)24(23)25(30)28-15-17-8-11-19(32-3)12-9-17/h4-14H,15H2,1-3H3,(H,28,30)