4-[4-[4-chloranyl-3-(trifluoromethyl)phenyl]-4-oxidanyl-piperidin-1-yl]-2-nitro-1-phenyl-butan-1-one

Systemtic Name: 4-[4-[4-chloranyl-3-(trifluoromethyl)phenyl]-4-oxidanyl-piperidin-1-yl]-2-nitro-1-phenyl-butan-1-one Openeye Name: 4-[4-[4-chloro-3-(trifluoromethyl)phenyl]-4-hydroxy-1-piperidyl]-2-nitro-1-phenyl-butan-1-one CAS Name: 4-[4-[4-chloro-3-(trifluoromethyl)phenyl]-4-hydroxy-1-piperidinyl]-2-nitro-1-phenyl-1-butanone IUPAC Name: 4-[4-[4-chloro-3-(trifluoromethyl)phenyl]-4-hydroxypiperidin-1-yl]-2-nitro-1-phenylbutan-1-one Traditional Name: 4-[4-[4-chloro-3-(trifluoromethyl)phenyl]-4-hydroxy-piperidino]-2-nitro-1-phenyl-butan-1-one Formula: C22H22ClF3N2O4 MolecularWeight: 470.86929

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC(=C(C=C2)Cl)C(F)(F)F)O)CCC(C(=O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1(C2=CC(=C(C=C2)Cl)C(F)(F)F)O)CCC(C(=O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H22ClF3N2O4/c23-18-7-6-16(14-17(18)22(24,25)26)21(30)9-12-27(13-10-21)11-8-19(28(31)32)20(29)15-4-2-1-3-5-15/h1-7,14,19,30H,8-13H2