4-(5,7-dimethyl-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-N-(pyridin-2-ylmethyl)butanamide

Systemtic Name: 4-(5,7-dimethyl-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-N-(pyridin-2-ylmethyl)butanamide Openeye Name: 4-(5,7-dimethyl-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-N-(2-pyridylmethyl)butanamide CAS Name: 4-(5,7-dimethyl-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-N-(2-pyridinylmethyl)butanamide IUPAC Name: 4-(5,7-dimethyl-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-N-(pyridin-2-ylmethyl)butanamide Traditional Name: 4-(5,7-dimethyl-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-4-keto-N-(2-pyridylmethyl)butyramide Formula: C27H29N3O2 MolecularWeight: 427.53806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2CCN(C(C2=C1)C3=CC=CC=C3)C(=O)CCC(=O)NCC4=CC=CC=N4)C

Isomeric SMILES

CC1=CC(=C2CCN(C(C2=C1)C3=CC=CC=C3)C(=O)CCC(=O)NCC4=CC=CC=N4)C

InChI

InChI=1S/C27H29N3O2/c1-19-16-20(2)23-13-15-30(27(24(23)17-19)21-8-4-3-5-9-21)26(32)12-11-25(31)29-18-22-10-6-7-14-28-22/h3-10,14,16-17,27H,11-13,15,18H2,1-2H3,(H,29,31)