2-[[1-[2-cyano-4-(trifluoromethyl)phenyl]piperidin-4-yl]amino]ethylcarbamic acid

Systemtic Name: 2-[[1-[2-cyano-4-(trifluoromethyl)phenyl]piperidin-4-yl]amino]ethylcarbamic acid Openeye Name: 2-[[1-[2-cyano-4-(trifluoromethyl)phenyl]-4-piperidyl]amino]ethylcarbamic acid CAS Name: 2-[[1-[2-cyano-4-(trifluoromethyl)phenyl]-4-piperidinyl]amino]ethylcarbamic acid IUPAC Name: 2-[[1-[2-cyano-4-(trifluoromethyl)phenyl]piperidin-4-yl]amino]ethylcarbamic acid Traditional Name: 2-[[1-[2-cyano-4-(trifluoromethyl)phenyl]-4-piperidyl]amino]ethylcarbamic acid Formula: C16H19F3N4O2 MolecularWeight: 356.34287

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NCCNC(=O)O)C2=C(C=C(C=C2)C(F)(F)F)C#N

Isomeric SMILES

C1CN(CCC1NCCNC(=O)O)C2=C(C=C(C=C2)C(F)(F)F)C#N

InChI

InChI=1S/C16H19F3N4O2/c17-16(18,19)12-1-2-14(11(9-12)10-20)23-7-3-13(4-8-23)21-5-6-22-15(24)25/h1-2,9,13,21-22H,3-8H2,(H,24,25)