2-[[1-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]piperidin-4-yl]methyl]-3H-isoindol-1-one hydrochloride

Systemtic Name: 2-[[1-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]piperidin-4-yl]methyl]-3H-isoindol-1-one hydrochloride Openeye Name: 2-[[1-[2-(4-methoxyphenyl)-2-oxo-ethyl]-4-piperidyl]methyl]isoindolin-1-one hydrochloride CAS Name: 2-[[1-[2-(4-methoxyphenyl)-2-oxoethyl]-4-piperidinyl]methyl]-3H-isoindol-1-one hydrochloride IUPAC Name: 2-[[1-[2-(4-methoxyphenyl)-2-oxoethyl]piperidin-4-yl]methyl]-3H-isoindol-1-one hydrochloride Traditional Name: 2-[[1-[2-keto-2-(4-methoxyphenyl)ethyl]-4-piperidyl]methyl]isoindolin-1-one hydrochloride Formula: C23H27ClN2O3 MolecularWeight: 414.92508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CN2CCC(CC2)CN3CC4=CC=CC=C4C3=O.Cl

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CN2CCC(CC2)CN3CC4=CC=CC=C4C3=O.Cl

InChI

InChI=1S/C23H26N2O3.ClH/c1-28-20-8-6-18(7-9-20)22(26)16-24-12-10-17(11-13-24)14-25-15-19-4-2-3-5-21(19)23(25)27;/h2-9,17H,10-16H2,1H3;1H