2-[[6-methoxy-1-oxidanylidene-2-[[1-(phenylmethyl)piperidin-4-yl]methyl]-2,3-dihydroinden-5-yl]oxy]ethanenitrile

Systemtic Name: 2-[[6-methoxy-1-oxidanylidene-2-[[1-(phenylmethyl)piperidin-4-yl]methyl]-2,3-dihydroinden-5-yl]oxy]ethanenitrile Openeye Name: 2-[2-[(1-benzyl-4-piperidyl)methyl]-6-methoxy-1-oxo-indan-5-yl]oxyacetonitrile CAS Name: 2-[[6-methoxy-1-oxo-2-[[1-(phenylmethyl)-4-piperidinyl]methyl]-2,3-dihydroinden-5-yl]oxy]acetonitrile IUPAC Name: 2-[[2-[(1-benzylpiperidin-4-yl)methyl]-6-methoxy-1-oxo-2,3-dihydroinden-5-yl]oxy]acetonitrile Traditional Name: 2-[2-[(1-benzyl-4-piperidyl)methyl]-1-keto-6-methoxy-indan-5-yl]oxyacetonitrile Formula: C25H28N2O3 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H28N2O3/c1-29-23-16-22-20(15-24(23)30-12-9-26)14-21(25(22)28)13-18-7-10-27(11-8-18)17-19-5-3-2-4-6-19/h2-6,15-16,18,21H,7-8,10-14,17H2,1H3