N-[5-(2-cyanopyrrolidin-1-yl)carbonylpyrrolidin-3-yl]-4-(trifluoromethyl)benzamide hydrochloride

Systemtic Name: N-[5-(2-cyanopyrrolidin-1-yl)carbonylpyrrolidin-3-yl]-4-(trifluoromethyl)benzamide hydrochloride Openeye Name: N-[5-(2-cyanopyrrolidine-1-carbonyl)pyrrolidin-3-yl]-4-(trifluoromethyl)benzamide hydrochloride CAS Name: N-[5-[(2-cyano-1-pyrrolidinyl)-oxomethyl]-3-pyrrolidinyl]-4-(trifluoromethyl)benzamide hydrochloride IUPAC Name: N-[5-(2-cyanopyrrolidine-1-carbonyl)pyrrolidin-3-yl]-4-(trifluoromethyl)benzamide hydrochloride Traditional Name: N-[5-(2-cyanopyrrolidine-1-carbonyl)pyrrolidin-3-yl]-4-(trifluoromethyl)benzamide hydrochloride Formula: C18H20ClF3N4O2 MolecularWeight: 416.82521

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2CC(CN2)NC(=O)C3=CC=C(C=C3)C(F)(F)F)C#N.Cl

Isomeric SMILES

C1CC(N(C1)C(=O)C2CC(CN2)NC(=O)C3=CC=C(C=C3)C(F)(F)F)C#N.Cl

InChI

InChI=1S/C18H19F3N4O2.ClH/c19-18(20,21)12-5-3-11(4-6-12)16(26)24-13-8-15(23-10-13)17(27)25-7-1-2-14(25)9-22;/h3-6,13-15,23H,1-2,7-8,10H2,(H,24,26);1H