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

Systemtic Name: 4-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-3-(4-fluorophenyl)carbonyl-2-phenyl-benzamide Openeye Name: 4-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-3-(4-fluorobenzoyl)-2-phenyl-benzamide CAS Name: 4-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-3-[(4-fluorophenyl)-oxomethyl]-2-phenylbenzamide IUPAC Name: 4-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-3-(4-fluorobenzoyl)-2-phenylbenzamide Traditional Name: 4-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-3-(4-fluorobenzoyl)-2-phenyl-benzamide Formula: C35H35FN2O4 MolecularWeight: 566.661803

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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=C(C=C5)F)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=C(C=C5)F)OC

InChI

InChI=1S/C35H35FN2O4/c1-41-30-20-26-17-19-38(22-27(26)21-31(30)42-2)18-7-6-10-24-13-16-29(35(37)40)32(23-8-4-3-5-9-23)33(24)34(39)25-11-14-28(36)15-12-25/h3-5,8-9,11-16,20-21H,6-7,10,17-19,22H2,1-2H3,(H2,37,40)