N-butyl-N-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-4-phenyl-benzamide

Systemtic Name: N-butyl-N-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-4-phenyl-benzamide Openeye Name: N-butyl-N-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-4-phenyl-benzamide CAS Name: N-butyl-N-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-4-phenylbenzamide IUPAC Name: N-butyl-N-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-4-phenylbenzamide Traditional Name: N-butyl-N-[2-keto-2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-4-phenyl-benzamide Formula: C29H32N2O2 MolecularWeight: 440.57658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N1CCC2=CC=CC=C2C1C)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCN(CC(=O)N1CCC2=CC=CC=C2C1C)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H32N2O2/c1-3-4-19-30(21-28(32)31-20-18-25-12-8-9-13-27(25)22(31)2)29(33)26-16-14-24(15-17-26)23-10-6-5-7-11-23/h5-17,22H,3-4,18-21H2,1-2H3