5-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]-2-(1-methylpyrrol-2-yl)pentanenitrile hydrochloride

Systemtic Name: 5-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]-2-(1-methylpyrrol-2-yl)pentanenitrile hydrochloride Openeye Name: 5-[4-(4-fluorobenzoyl)-1-piperidyl]-2-(1-methylpyrrol-2-yl)pentanenitrile hydrochloride CAS Name: 5-[4-[(4-fluorophenyl)-oxomethyl]-1-piperidinyl]-2-(1-methyl-2-pyrrolyl)pentanenitrile hydrochloride IUPAC Name: 5-[4-(4-fluorobenzoyl)piperidin-1-yl]-2-(1-methylpyrrol-2-yl)pentanenitrile hydrochloride Traditional Name: 5-[4-(4-fluorobenzoyl)piperidino]-2-(1-methylpyrrol-2-yl)valeronitrile hydrochloride Formula: C22H27ClFN3O MolecularWeight: 403.920683

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(CCCN2CCC(CC2)C(=O)C3=CC=C(C=C3)F)C#N.Cl

Isomeric SMILES

CN1C=CC=C1C(CCCN2CCC(CC2)C(=O)C3=CC=C(C=C3)F)C#N.Cl

InChI

InChI=1S/C22H26FN3O.ClH/c1-25-12-3-5-21(25)19(16-24)4-2-13-26-14-10-18(11-15-26)22(27)17-6-8-20(23)9-7-17;/h3,5-9,12,18-19H,2,4,10-11,13-15H2,1H3;1H