N-[(4-methylphenyl)methyl]-4-oxidanylidene-4-(1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)butanamide

Systemtic Name: N-[(4-methylphenyl)methyl]-4-oxidanylidene-4-(1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)butanamide Openeye Name: 4-oxo-4-(1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-N-(p-tolylmethyl)butanamide CAS Name: N-[(4-methylphenyl)methyl]-4-oxo-4-(1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)butanamide IUPAC Name: N-[(4-methylphenyl)methyl]-4-oxo-4-(1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)butanamide Traditional Name: 4-keto-N-(4-methylbenzyl)-4-(1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)butyramide Formula: C27H28N2O2 MolecularWeight: 412.52342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)CCC(=O)N2CCC3=CC=CC=C3C2C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)CCC(=O)N2CCC3=CC=CC=C3C2C4=CC=CC=C4

InChI

InChI=1S/C27H28N2O2/c1-20-11-13-21(14-12-20)19-28-25(30)15-16-26(31)29-18-17-22-7-5-6-10-24(22)27(29)23-8-3-2-4-9-23/h2-14,27H,15-19H2,1H3,(H,28,30)