4-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-2-phenyl-3-(phenylcarbonyl)benzamide

Systemtic Name: 4-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-2-phenyl-3-(phenylcarbonyl)benzamide Openeye Name: 3-benzoyl-4-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-2-phenyl-benzamide CAS Name: 3-benzoyl-4-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-2-phenylbenzamide IUPAC Name: 3-benzoyl-4-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-2-phenylbenzamide Traditional Name: 3-benzoyl-4-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-2-phenyl-benzamide Formula: C35H36N2O4 MolecularWeight: 548.67134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CCCCC3=C(C(=C(C=C3)C(=O)N)C4=CC=CC=C4)C(=O)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)CCCCC3=C(C(=C(C=C3)C(=O)N)C4=CC=CC=C4)C(=O)C5=CC=CC=C5)OC

InChI

InChI=1S/C35H36N2O4/c1-40-30-21-27-18-20-37(23-28(27)22-31(30)41-2)19-10-9-13-25-16-17-29(35(36)39)32(24-11-5-3-6-12-24)33(25)34(38)26-14-7-4-8-15-26/h3-8,11-12,14-17,21-22H,9-10,13,18-20,23H2,1-2H3,(H2,36,39)