5-(4-fluorophenyl)-4-methyl-5-oxidanylidene-2-phenyl-2-piperidin-1-yl-pentanenitrile hydrochloride

Systemtic Name: 5-(4-fluorophenyl)-4-methyl-5-oxidanylidene-2-phenyl-2-piperidin-1-yl-pentanenitrile hydrochloride Openeye Name: 5-(4-fluorophenyl)-4-methyl-5-oxo-2-phenyl-2-(1-piperidyl)pentanenitrile hydrochloride CAS Name: 5-(4-fluorophenyl)-4-methyl-5-oxo-2-phenyl-2-(1-piperidinyl)pentanenitrile hydrochloride IUPAC Name: 5-(4-fluorophenyl)-4-methyl-5-oxo-2-phenyl-2-piperidin-1-ylpentanenitrile hydrochloride Traditional Name: 5-(4-fluorophenyl)-5-keto-4-methyl-2-phenyl-2-piperidino-valeronitrile hydrochloride Formula: C23H26ClFN2O MolecularWeight: 400.916743

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C#N)(C1=CC=CC=C1)N2CCCCC2)C(=O)C3=CC=C(C=C3)F.Cl

Isomeric SMILES

CC(CC(C#N)(C1=CC=CC=C1)N2CCCCC2)C(=O)C3=CC=C(C=C3)F.Cl

InChI

InChI=1S/C23H25FN2O.ClH/c1-18(22(27)19-10-12-21(24)13-11-19)16-23(17-25,20-8-4-2-5-9-20)26-14-6-3-7-15-26;/h2,4-5,8-13,18H,3,6-7,14-16H2,1H3;1H