(1R)-6,7-dimethoxy-1-(4-methoxyphenyl)-N-(3-oxidanylidene-3-phenylazanyl-propyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: (1R)-6,7-dimethoxy-1-(4-methoxyphenyl)-N-(3-oxidanylidene-3-phenylazanyl-propyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: (1R)-N-(3-anilino-3-oxo-propyl)-6,7-dimethoxy-1-(4-methoxyphenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: (1R)-N-(3-anilino-3-oxopropyl)-6,7-dimethoxy-1-(4-methoxyphenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: (1R)-N-(3-anilino-3-oxopropyl)-6,7-dimethoxy-1-(4-methoxyphenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: (1R)-N-(3-anilino-3-keto-propyl)-6,7-dimethoxy-1-(4-methoxyphenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C28H31N3O5 MolecularWeight: 489.56284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C3=CC(=C(C=C3CCN2C(=O)NCCC(=O)NC4=CC=CC=C4)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H]2C3=CC(=C(C=C3CCN2C(=O)NCCC(=O)NC4=CC=CC=C4)OC)OC

InChI

InChI=1S/C28H31N3O5/c1-34-22-11-9-19(10-12-22)27-23-18-25(36-3)24(35-2)17-20(23)14-16-31(27)28(33)29-15-13-26(32)30-21-7-5-4-6-8-21/h4-12,17-18,27H,13-16H2,1-3H3,(H,29,33)(H,30,32)/t27-/m1/s1