methyl (1R,3S)-6,7-dimethoxy-1-phenyl-2-(phenylmethyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: methyl (1R,3S)-6,7-dimethoxy-1-phenyl-2-(phenylmethyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl (1R,3S)-2-benzyl-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: (1R,3S)-6,7-dimethoxy-1-phenyl-2-(phenylmethyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (1R,3S)-2-benzyl-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: (1R,3S)-2-benzyl-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C26H27NO4 MolecularWeight: 417.49688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(C(CC2=C1)C(=O)OC)CC3=CC=CC=C3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2[C@H](N([C@@H](CC2=C1)C(=O)OC)CC3=CC=CC=C3)C4=CC=CC=C4)OC

InChI

InChI=1S/C26H27NO4/c1-29-23-15-20-14-22(26(28)31-3)27(17-18-10-6-4-7-11-18)25(19-12-8-5-9-13-19)21(20)16-24(23)30-2/h4-13,15-16,22,25H,14,17H2,1-3H3/t22-,25+/m0/s1