O3-methyl O2-(phenylmethyl) (1S,3S)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline-2,3-dicarboxylate

Systemtic Name: O3-methyl O2-(phenylmethyl) (1S,3S)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline-2,3-dicarboxylate Openeye Name: O2-benzyl O3-methyl (1S,3S)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline-2,3-dicarboxylate CAS Name: (1S,3S)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline-2,3-dicarboxylic acid O3-methyl ester O2-(phenylmethyl) ester IUPAC Name: 2-O-benzyl 3-O-methyl (1S,3S)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline-2,3-dicarboxylate Traditional Name: (1S,3S)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline-2,3-dicarboxylic acid O2-benzyl ester O3-methyl ester Formula: C27H27NO6 MolecularWeight: 461.50638

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(C(CC2=C1)C(=O)OC)C(=O)OCC3=CC=CC=C3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2[C@@H](N([C@@H](CC2=C1)C(=O)OC)C(=O)OCC3=CC=CC=C3)C4=CC=CC=C4)OC

InChI

InChI=1S/C27H27NO6/c1-31-23-15-20-14-22(26(29)33-3)28(27(30)34-17-18-10-6-4-7-11-18)25(19-12-8-5-9-13-19)21(20)16-24(23)32-2/h4-13,15-16,22,25H,14,17H2,1-3H3/t22-,25-/m0/s1