2-[[2-fluoranyl-6-methoxy-1-oxidanylidene-2-[[1-(phenylmethyl)piperidin-4-yl]methyl]-3H-inden-5-yl]oxy]ethanenitrile

Systemtic Name: 2-[[2-fluoranyl-6-methoxy-1-oxidanylidene-2-[[1-(phenylmethyl)piperidin-4-yl]methyl]-3H-inden-5-yl]oxy]ethanenitrile Openeye Name: 2-[2-[(1-benzyl-4-piperidyl)methyl]-2-fluoro-6-methoxy-1-oxo-indan-5-yl]oxyacetonitrile CAS Name: 2-[[2-fluoro-6-methoxy-1-oxo-2-[[1-(phenylmethyl)-4-piperidinyl]methyl]-3H-inden-5-yl]oxy]acetonitrile IUPAC Name: 2-[[2-[(1-benzylpiperidin-4-yl)methyl]-2-fluoro-6-methoxy-1-oxo-3H-inden-5-yl]oxy]acetonitrile Traditional Name: 2-[2-[(1-benzyl-4-piperidyl)methyl]-2-fluoro-1-keto-6-methoxy-indan-5-yl]oxyacetonitrile Formula: C25H27FN2O3 MolecularWeight: 422.491883

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CC(C(=O)C2=C1)(CC3CCN(CC3)CC4=CC=CC=C4)F)OCC#N

Isomeric SMILES

COC1=C(C=C2CC(C(=O)C2=C1)(CC3CCN(CC3)CC4=CC=CC=C4)F)OCC#N

InChI

InChI=1S/C25H27FN2O3/c1-30-22-14-21-20(13-23(22)31-12-9-27)16-25(26,24(21)29)15-18-7-10-28(11-8-18)17-19-5-3-2-4-6-19/h2-6,13-14,18H,7-8,10-12,15-17H2,1H3