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

Systemtic Name: 5,6-diethoxy-2-fluoranyl-2-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methyl]-3H-inden-1-one Openeye Name: 5,6-diethoxy-2-fluoro-2-[[1-(p-tolylmethyl)-4-piperidyl]methyl]indan-1-one CAS Name: 5,6-diethoxy-2-fluoro-2-[[1-[(4-methylphenyl)methyl]-4-piperidinyl]methyl]-3H-inden-1-one IUPAC Name: 5,6-diethoxy-2-fluoro-2-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methyl]-3H-inden-1-one Traditional Name: 5,6-diethoxy-2-fluoro-2-[[1-(4-methylbenzyl)-4-piperidyl]methyl]indan-1-one Formula: C27H34FNO3 MolecularWeight: 439.562163

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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)F)OCC

Isomeric SMILES

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

InChI

InChI=1S/C27H34FNO3/c1-4-31-24-14-22-17-27(28,26(30)23(22)15-25(24)32-5-2)16-20-10-12-29(13-11-20)18-21-8-6-19(3)7-9-21/h6-9,14-15,20H,4-5,10-13,16-18H2,1-3H3