4-(5-methyl-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-N-(phenylmethyl)butanamide

Systemtic Name: 4-(5-methyl-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-4-(5-methyl-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-butanamide CAS Name: 4-(5-methyl-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-4-(5-methyl-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxobutanamide Traditional Name: N-benzyl-4-keto-4-(5-methyl-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=CC2=C1CCN(C2C3=CC=CC=C3)C(=O)CCC(=O)NCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC2=C1CCN(C2C3=CC=CC=C3)C(=O)CCC(=O)NCC4=CC=CC=C4

InChI

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