N-phenyl-1-pyrazol-1-yl-3,5-bis(trifluoromethyl)piperidine-4-carboxamide hydrochloride

Systemtic Name: N-phenyl-1-pyrazol-1-yl-3,5-bis(trifluoromethyl)piperidine-4-carboxamide hydrochloride Openeye Name: N-phenyl-1-pyrazol-1-yl-3,5-bis(trifluoromethyl)piperidine-4-carboxamide hydrochloride CAS Name: N-phenyl-1-(1-pyrazolyl)-3,5-bis(trifluoromethyl)-4-piperidinecarboxamide hydrochloride IUPAC Name: N-phenyl-1-pyrazol-1-yl-3,5-bis(trifluoromethyl)piperidine-4-carboxamide hydrochloride Traditional Name: N-phenyl-1-pyrazol-1-yl-3,5-bis(trifluoromethyl)isonipecotamide hydrochloride Formula: C17H17ClF6N4O MolecularWeight: 442.786499

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(CN1N2C=CC=N2)C(F)(F)F)C(=O)NC3=CC=CC=C3)C(F)(F)F.Cl

Isomeric SMILES

C1C(C(C(CN1N2C=CC=N2)C(F)(F)F)C(=O)NC3=CC=CC=C3)C(F)(F)F.Cl

InChI

InChI=1S/C17H16F6N4O.ClH/c18-16(19,20)12-9-26(27-8-4-7-24-27)10-13(17(21,22)23)14(12)15(28)25-11-5-2-1-3-6-11;/h1-8,12-14H,9-10H2,(H,25,28);1H