2-[2-[[3-azanyl-2-(trifluoromethyl)quinolin-4-yl]amino]ethyl]piperidine-1-carboxylate

Systemtic Name: 2-[2-[[3-azanyl-2-(trifluoromethyl)quinolin-4-yl]amino]ethyl]piperidine-1-carboxylate Openeye Name: 2-[2-[[3-amino-2-(trifluoromethyl)-4-quinolyl]amino]ethyl]piperidine-1-carboxylate CAS Name: 2-[2-[[3-amino-2-(trifluoromethyl)-4-quinolinyl]amino]ethyl]-1-piperidinecarboxylate IUPAC Name: 2-[2-[[3-amino-2-(trifluoromethyl)quinolin-4-yl]amino]ethyl]piperidine-1-carboxylate Traditional Name: 2-[2-[[3-amino-2-(trifluoromethyl)-4-quinolyl]amino]ethyl]piperidine-1-carboxylate Formula: C18H20F3N4O2- MolecularWeight: 381.37221

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CCNC2=C(C(=NC3=CC=CC=C32)C(F)(F)F)N)C(=O)[O-]

Isomeric SMILES

C1CCN(C(C1)CCNC2=C(C(=NC3=CC=CC=C32)C(F)(F)F)N)C(=O)[O-]

InChI

InChI=1S/C18H21F3N4O2/c19-18(20,21)16-14(22)15(12-6-1-2-7-13(12)24-16)23-9-8-11-5-3-4-10-25(11)17(26)27/h1-2,6-7,11H,3-5,8-10,22H2,(H,23,24)(H,26,27)/p-1