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

Systemtic Name: 5,6-dimethoxy-3-oxidanyl-2-[[1-(phenylmethyl)piperidin-4-yl]methyl]inden-1-one Openeye Name: 2-[(1-benzyl-4-piperidyl)methyl]-3-hydroxy-5,6-dimethoxy-inden-1-one CAS Name: 3-hydroxy-5,6-dimethoxy-2-[[1-(phenylmethyl)-4-piperidinyl]methyl]-1-indenone IUPAC Name: 2-[(1-benzylpiperidin-4-yl)methyl]-3-hydroxy-5,6-dimethoxyinden-1-one Traditional Name: 2-[(1-benzyl-4-piperidyl)methyl]-3-hydroxy-5,6-dimethoxy-inden-1-one Formula: C24H27NO4 MolecularWeight: 393.47548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27NO4/c1-28-21-13-18-19(14-22(21)29-2)24(27)20(23(18)26)12-16-8-10-25(11-9-16)15-17-6-4-3-5-7-17/h3-7,13-14,16,26H,8-12,15H2,1-2H3