[3-nitro-4-[3-(trifluoromethyl)piperidin-1-yl]phenyl]-phenyl-methanone

Systemtic Name: [3-nitro-4-[3-(trifluoromethyl)piperidin-1-yl]phenyl]-phenyl-methanone Openeye Name: [3-nitro-4-[3-(trifluoromethyl)-1-piperidyl]phenyl]-phenyl-methanone CAS Name: [3-nitro-4-[3-(trifluoromethyl)-1-piperidinyl]phenyl]-phenylmethanone IUPAC Name: [3-nitro-4-[3-(trifluoromethyl)piperidin-1-yl]phenyl]-phenylmethanone Traditional Name: [3-nitro-4-[3-(trifluoromethyl)piperidino]phenyl]-phenyl-methanone Formula: C19H17F3N2O3 MolecularWeight: 378.34509

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=C(C=C(C=C2)C(=O)C3=CC=CC=C3)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1CC(CN(C1)C2=C(C=C(C=C2)C(=O)C3=CC=CC=C3)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C19H17F3N2O3/c20-19(21,22)15-7-4-10-23(12-15)16-9-8-14(11-17(16)24(26)27)18(25)13-5-2-1-3-6-13/h1-3,5-6,8-9,11,15H,4,7,10,12H2