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

Systemtic Name: 5,6-dimethoxy-2-[[1-(phenylmethyl)piperidin-4-yl]methyl]indene-1,3-dione Openeye Name: 2-[(1-benzyl-4-piperidyl)methyl]-5,6-dimethoxy-indane-1,3-dione CAS Name: 5,6-dimethoxy-2-[[1-(phenylmethyl)-4-piperidinyl]methyl]indene-1,3-dione IUPAC Name: 2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxyindene-1,3-dione Traditional Name: 2-[(1-benzyl-4-piperidyl)methyl]-5,6-dimethoxy-indane-1,3-quinone Formula: C24H27NO4 MolecularWeight: 396.453445

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1=C(C=C2C(=C1)[13C](=O)[13CH]([13C]2=O)CC3CCN(CC3)CC4=CC=CC=C4)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/h3-7,13-14,16,20H,8-12,15H2,1-2H3/i20+1,23+1,24+1