dimethyl 1-cyclopropyl-9-methoxy-8-oxidanyl-2-[[3-(trifluoromethyloxy)phenyl]methyl]-1H-2-benzazocine-4,5-dicarboxylate

Systemtic Name: dimethyl 1-cyclopropyl-9-methoxy-8-oxidanyl-2-[[3-(trifluoromethyloxy)phenyl]methyl]-1H-2-benzazocine-4,5-dicarboxylate Openeye Name: dimethyl 1-cyclopropyl-8-hydroxy-9-methoxy-2-[[3-(trifluoromethoxy)phenyl]methyl]-1H-2-benzazocine-4,5-dicarboxylate CAS Name: 1-cyclopropyl-8-hydroxy-9-methoxy-2-[[3-(trifluoromethoxy)phenyl]methyl]-1H-2-benzazocine-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-cyclopropyl-8-hydroxy-9-methoxy-2-[[3-(trifluoromethoxy)phenyl]methyl]-1H-2-benzazocine-4,5-dicarboxylate Traditional Name: 1-cyclopropyl-8-hydroxy-9-methoxy-2-[3-(trifluoromethoxy)benzyl]-1H-2-benzazocine-4,5-dicarboxylic acid dimethyl ester Formula: C27H26F3NO7 MolecularWeight: 533.49305

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C=C(C(=CN(C(C2=C1)C3CC3)CC4=CC(=CC=C4)OC(F)(F)F)C(=O)OC)C(=O)OC)O

Isomeric SMILES

COC1=C(C=C2C=C(C(=CN(C(C2=C1)C3CC3)CC4=CC(=CC=C4)OC(F)(F)F)C(=O)OC)C(=O)OC)O

InChI

InChI=1S/C27H26F3NO7/c1-35-23-12-19-17(11-22(23)32)10-20(25(33)36-2)21(26(34)37-3)14-31(24(19)16-7-8-16)13-15-5-4-6-18(9-15)38-27(28,29)30/h4-6,9-12,14,16,24,32H,7-8,13H2,1-3H3