methyl 5,6-dimethoxy-3-oxidanylidene-2-[[1-(phenylmethyl)piperidin-4-yl]methyl]-1H-indene-2-carboxylate

Systemtic Name: methyl 5,6-dimethoxy-3-oxidanylidene-2-[[1-(phenylmethyl)piperidin-4-yl]methyl]-1H-indene-2-carboxylate Openeye Name: methyl 2-[(1-benzyl-4-piperidyl)methyl]-5,6-dimethoxy-1-oxo-indane-2-carboxylate CAS Name: 5,6-dimethoxy-3-oxo-2-[[1-(phenylmethyl)-4-piperidinyl]methyl]-1H-indene-2-carboxylic acid methyl ester IUPAC Name: methyl 2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-3-oxo-1H-indene-2-carboxylate Traditional Name: 2-[(1-benzyl-4-piperidyl)methyl]-1-keto-5,6-dimethoxy-indane-2-carboxylic acid methyl ester Formula: C26H31NO5 MolecularWeight: 437.52804

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CC(C2=O)(CC3CCN(CC3)CC4=CC=CC=C4)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CC(C2=O)(CC3CCN(CC3)CC4=CC=CC=C4)C(=O)OC)OC

InChI

InChI=1S/C26H31NO5/c1-30-22-13-20-16-26(25(29)32-3,24(28)21(20)14-23(22)31-2)15-18-9-11-27(12-10-18)17-19-7-5-4-6-8-19/h4-8,13-14,18H,9-12,15-17H2,1-3H3