2-[2-(3,5-dimethoxy-4-methyl-phenyl)-2-oxidanylidene-ethanoyl]-N-(1,7-diphenylheptan-4-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-[2-(3,5-dimethoxy-4-methyl-phenyl)-2-oxidanylidene-ethanoyl]-N-(1,7-diphenylheptan-4-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-[2-(3,5-dimethoxy-4-methyl-phenyl)-2-oxo-acetyl]-N-[4-phenyl-1-(3-phenylpropyl)butyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-[2-(3,5-dimethoxy-4-methylphenyl)-1,2-dioxoethyl]-N-(1,7-diphenylheptan-4-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-[2-(3,5-dimethoxy-4-methylphenyl)-2-oxoacetyl]-N-(1,7-diphenylheptan-4-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-[2-(3,5-dimethoxy-4-methyl-phenyl)-2-keto-acetyl]-N-[4-phenyl-1-(3-phenylpropyl)butyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C40H44N2O5 MolecularWeight: 632.78776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1OC)C(=O)C(=O)N2CC3=CC=CC=C3CC2C(=O)NC(CCCC4=CC=CC=C4)CCCC5=CC=CC=C5)OC

Isomeric SMILES

CC1=C(C=C(C=C1OC)C(=O)C(=O)N2CC3=CC=CC=C3CC2C(=O)NC(CCCC4=CC=CC=C4)CCCC5=CC=CC=C5)OC

InChI

InChI=1S/C40H44N2O5/c1-28-36(46-2)25-33(26-37(28)47-3)38(43)40(45)42-27-32-21-11-10-20-31(32)24-35(42)39(44)41-34(22-12-18-29-14-6-4-7-15-29)23-13-19-30-16-8-5-9-17-30/h4-11,14-17,20-21,25-26,34-35H,12-13,18-19,22-24,27H2,1-3H3,(H,41,44)