(3R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline-3-carboxylate

Systemtic Name: (3R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline-3-carboxylate Openeye Name: (3R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline-3-carboxylate CAS Name: (3R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline-3-carboxylate IUPAC Name: (3R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline-3-carboxylate Traditional Name: (3R)-6,7-dimethoxy-1-veratryl-3,4-dihydroisoquinoline-3-carboxylate Formula: C21H22NO6- MolecularWeight: 384.40248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2=NC(CC3=CC(=C(C=C32)OC)OC)C(=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC2=N[C@H](CC3=CC(=C(C=C32)OC)OC)C(=O)[O-])OC

InChI

InChI=1S/C21H23NO6/c1-25-17-6-5-12(8-18(17)26-2)7-15-14-11-20(28-4)19(27-3)10-13(14)9-16(22-15)21(23)24/h5-6,8,10-11,16H,7,9H2,1-4H3,(H,23,24)/p-1/t16-/m1/s1