4-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-4-fluoranyl-2-nitro-1-phenyl-butan-1-one hydrochloride

Systemtic Name: 4-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-4-fluoranyl-2-nitro-1-phenyl-butan-1-one hydrochloride Openeye Name: 4-[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]-4-fluoro-2-nitro-1-phenyl-butan-1-one hydrochloride CAS Name: 4-[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]-4-fluoro-2-nitro-1-phenyl-1-butanone hydrochloride IUPAC Name: 4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-4-fluoro-2-nitro-1-phenylbutan-1-one hydrochloride Traditional Name: 4-[4-(4-chlorophenyl)-4-hydroxy-piperidino]-4-fluoro-2-nitro-1-phenyl-butan-1-one hydrochloride Formula: C21H23Cl2FN2O4 MolecularWeight: 457.322723

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22ClFN2O4.ClH/c22-17-8-6-16(7-9-17)21(27)10-12-24(13-11-21)19(23)14-18(25(28)29)20(26)15-4-2-1-3-5-15;/h1-9,18-19,27H,10-14H2;1H