5,6-diethoxy-2-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methyl]-2,3-dihydroinden-1-one

Systemtic Name: 5,6-diethoxy-2-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methyl]-2,3-dihydroinden-1-one Openeye Name: 5,6-diethoxy-2-[[1-(p-tolylmethyl)-4-piperidyl]methyl]indan-1-one CAS Name: 5,6-diethoxy-2-[[1-[(4-methylphenyl)methyl]-4-piperidinyl]methyl]-2,3-dihydroinden-1-one IUPAC Name: 5,6-diethoxy-2-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methyl]-2,3-dihydroinden-1-one Traditional Name: 5,6-diethoxy-2-[[1-(4-methylbenzyl)-4-piperidyl]methyl]indan-1-one Formula: C27H35NO3 MolecularWeight: 421.5717

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(C2=O)CC3CCN(CC3)CC4=CC=C(C=C4)C)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CC(C2=O)CC3CCN(CC3)CC4=CC=C(C=C4)C)OCC

InChI

InChI=1S/C27H35NO3/c1-4-30-25-16-22-15-23(27(29)24(22)17-26(25)31-5-2)14-20-10-12-28(13-11-20)18-21-8-6-19(3)7-9-21/h6-9,16-17,20,23H,4-5,10-15,18H2,1-3H3