2-(3,4-dimethoxyphenyl)sulfonyl-N-(1,7-diphenylheptan-4-yl)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-(3,4-dimethoxyphenyl)sulfonyl-N-(1,7-diphenylheptan-4-yl)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-(3,4-dimethoxyphenyl)sulfonyl-6,7-dimethoxy-1-phenyl-N-[4-phenyl-1-(3-phenylpropyl)butyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-(3,4-dimethoxyphenyl)sulfonyl-N-(1,7-diphenylheptan-4-yl)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-(3,4-dimethoxyphenyl)sulfonyl-N-(1,7-diphenylheptan-4-yl)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-(3,4-dimethoxyphenyl)sulfonyl-6,7-dimethoxy-1-phenyl-N-[4-phenyl-1-(3-phenylpropyl)butyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C45H50N2O7S MolecularWeight: 762.9527

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2C(CC3=CC(=C(C=C3C2C4=CC=CC=C4)OC)OC)C(=O)NC(CCCC5=CC=CC=C5)CCCC6=CC=CC=C6)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2C(CC3=CC(=C(C=C3C2C4=CC=CC=C4)OC)OC)C(=O)NC(CCCC5=CC=CC=C5)CCCC6=CC=CC=C6)OC

InChI

InChI=1S/C45H50N2O7S/c1-51-40-27-26-37(30-42(40)53-3)55(49,50)47-39(28-35-29-41(52-2)43(54-4)31-38(35)44(47)34-22-12-7-13-23-34)45(48)46-36(24-14-20-32-16-8-5-9-17-32)25-15-21-33-18-10-6-11-19-33/h5-13,16-19,22-23,26-27,29-31,36,39,44H,14-15,20-21,24-25,28H2,1-4H3,(H,46,48)