5-(4-fluorophenyl)-4-methyl-2-naphthalen-2-yl-5-oxidanylidene-3-piperidin-1-yl-2-propan-2-yl-pentanenitrile hydrochloride

Systemtic Name: 5-(4-fluorophenyl)-4-methyl-2-naphthalen-2-yl-5-oxidanylidene-3-piperidin-1-yl-2-propan-2-yl-pentanenitrile hydrochloride Openeye Name: 5-(4-fluorophenyl)-2-isopropyl-4-methyl-2-(2-naphthyl)-5-oxo-3-(1-piperidyl)pentanenitrile hydrochloride CAS Name: 5-(4-fluorophenyl)-4-methyl-2-(2-naphthalenyl)-5-oxo-3-(1-piperidinyl)-2-propan-2-ylpentanenitrile hydrochloride IUPAC Name: 5-(4-fluorophenyl)-4-methyl-2-naphthalen-2-yl-5-oxo-3-piperidin-1-yl-2-propan-2-ylpentanenitrile hydrochloride Traditional Name: 5-(4-fluorophenyl)-2-isopropyl-5-keto-4-methyl-2-(2-naphthyl)-3-piperidino-valeronitrile hydrochloride Formula: C30H34ClFN2O MolecularWeight: 493.055163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C#N)(C1=CC2=CC=CC=C2C=C1)C(C(C)C(=O)C3=CC=C(C=C3)F)N4CCCCC4.Cl

Isomeric SMILES

CC(C)C(C#N)(C1=CC2=CC=CC=C2C=C1)C(C(C)C(=O)C3=CC=C(C=C3)F)N4CCCCC4.Cl

InChI

InChI=1S/C30H33FN2O.ClH/c1-21(2)30(20-32,26-14-11-23-9-5-6-10-25(23)19-26)29(33-17-7-4-8-18-33)22(3)28(34)24-12-15-27(31)16-13-24;/h5-6,9-16,19,21-22,29H,4,7-8,17-18H2,1-3H3;1H