(3S)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidin-3-amine

Systemtic Name: (3S)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidin-3-amine Openeye Name: (3S)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidin-3-amine CAS Name: (3S)-1-[2-nitro-4-(trifluoromethyl)phenyl]-3-piperidinamine IUPAC Name: (3S)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidin-3-amine Traditional Name: [(3S)-1-[2-nitro-4-(trifluoromethyl)phenyl]-3-piperidyl]amine Formula: C12H14F3N3O2 MolecularWeight: 289.25367

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])N

Isomeric SMILES

C1C[C@@H](CN(C1)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])N

InChI

InChI=1S/C12H14F3N3O2/c13-12(14,15)8-3-4-10(11(6-8)18(19)20)17-5-1-2-9(16)7-17/h3-4,6,9H,1-2,5,7,16H2/t9-/m0/s1