(2R)-4-[2-(trifluoromethyl)quinolin-4-yl]piperazin-1-ium-2-carboxamide

Systemtic Name: (2R)-4-[2-(trifluoromethyl)quinolin-4-yl]piperazin-1-ium-2-carboxamide Openeye Name: (2R)-4-[2-(trifluoromethyl)-4-quinolyl]piperazin-1-ium-2-carboxamide CAS Name: (2R)-4-[2-(trifluoromethyl)-4-quinolinyl]-2-piperazin-1-iumcarboxamide IUPAC Name: (2R)-4-[2-(trifluoromethyl)quinolin-4-yl]piperazin-1-ium-2-carboxamide Traditional Name: (2R)-4-[2-(trifluoromethyl)-4-quinolyl]piperazin-1-ium-2-carboxamide Formula: C15H16F3N4O+ MolecularWeight: 325.30895

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC([NH2+]1)C(=O)N)C2=CC(=NC3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

C1CN(C[C@@H]([NH2+]1)C(=O)N)C2=CC(=NC3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C15H15F3N4O/c16-15(17,18)13-7-12(9-3-1-2-4-10(9)21-13)22-6-5-20-11(8-22)14(19)23/h1-4,7,11,20H,5-6,8H2,(H2,19,23)/p+1/t11-/m1/s1