1-[[3-nitro-5-(trifluoromethyl)phenyl]methyl]-3-phenyl-piperidin-2-one

Systemtic Name: 1-[[3-nitro-5-(trifluoromethyl)phenyl]methyl]-3-phenyl-piperidin-2-one Openeye Name: 1-[[3-nitro-5-(trifluoromethyl)phenyl]methyl]-3-phenyl-piperidin-2-one CAS Name: 1-[[3-nitro-5-(trifluoromethyl)phenyl]methyl]-3-phenyl-2-piperidinone IUPAC Name: 1-[[3-nitro-5-(trifluoromethyl)phenyl]methyl]-3-phenylpiperidin-2-one Traditional Name: 1-[3-nitro-5-(trifluoromethyl)benzyl]-3-phenyl-2-piperidone Formula: C19H17F3N2O3 MolecularWeight: 378.34509

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)N(C1)CC2=CC(=CC(=C2)[N+](=O)[O-])C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

C1CC(C(=O)N(C1)CC2=CC(=CC(=C2)[N+](=O)[O-])C(F)(F)F)C3=CC=CC=C3

InChI

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