6-methoxy-5-oxidanyl-2-[[1-(phenylmethyl)piperidin-4-yl]methyl]-2,3-dihydroinden-1-one; sulfuric acid

Systemtic Name: 6-methoxy-5-oxidanyl-2-[[1-(phenylmethyl)piperidin-4-yl]methyl]-2,3-dihydroinden-1-one; sulfuric acid Openeye Name: 2-[(1-benzyl-4-piperidyl)methyl]-5-hydroxy-6-methoxy-indan-1-one; sulfuric acid CAS Name: 5-hydroxy-6-methoxy-2-[[1-(phenylmethyl)-4-piperidinyl]methyl]-2,3-dihydroinden-1-one; sulfuric acid IUPAC Name: 2-[(1-benzylpiperidin-4-yl)methyl]-5-hydroxy-6-methoxy-2,3-dihydroinden-1-one; sulfuric acid Traditional Name: 2-[(1-benzyl-4-piperidyl)methyl]-5-hydroxy-6-methoxy-indan-1-one; sulfuric acid Formula: C23H29NO7S MolecularWeight: 463.54386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CC(C(=O)C2=C1)CC3CCN(CC3)CC4=CC=CC=C4)O.OS(=O)(=O)O

Isomeric SMILES

COC1=C(C=C2CC(C(=O)C2=C1)CC3CCN(CC3)CC4=CC=CC=C4)O.OS(=O)(=O)O

InChI

InChI=1S/C23H27NO3.H2O4S/c1-27-22-14-20-18(13-21(22)25)12-19(23(20)26)11-16-7-9-24(10-8-16)15-17-5-3-2-4-6-17;1-5(2,3)4/h2-6,13-14,16,19,25H,7-12,15H2,1H3;(H2,1,2,3,4)