[5,6-dimethoxy-2-[[1-(phenylmethyl)piperidin-4-yl]methyl]-3H-inden-1-yl] benzoate

Systemtic Name: [5,6-dimethoxy-2-[[1-(phenylmethyl)piperidin-4-yl]methyl]-3H-inden-1-yl] benzoate Openeye Name: [2-[(1-benzyl-4-piperidyl)methyl]-5,6-dimethoxy-3H-inden-1-yl] benzoate CAS Name: benzoic acid [5,6-dimethoxy-2-[[1-(phenylmethyl)-4-piperidinyl]methyl]-3H-inden-1-yl] ester IUPAC Name: [2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-3H-inden-1-yl] benzoate Traditional Name: benzoic acid [2-[(1-benzyl-4-piperidyl)methyl]-5,6-dimethoxy-3H-inden-1-yl] ester Formula: C31H33NO4 MolecularWeight: 483.59802

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CC(=C2OC(=O)C3=CC=CC=C3)CC4CCN(CC4)CC5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CC(=C2OC(=O)C3=CC=CC=C3)CC4CCN(CC4)CC5=CC=CC=C5)OC

InChI

InChI=1S/C31H33NO4/c1-34-28-19-25-18-26(17-22-13-15-32(16-14-22)21-23-9-5-3-6-10-23)30(27(25)20-29(28)35-2)36-31(33)24-11-7-4-8-12-24/h3-12,19-20,22H,13-18,21H2,1-2H3