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

Systemtic Name: 4-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-2-nitro-1-phenyl-butan-1-one Openeye Name: 4-[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]-2-nitro-1-phenyl-butan-1-one CAS Name: 4-[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]-2-nitro-1-phenyl-1-butanone IUPAC Name: 4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-nitro-1-phenylbutan-1-one Traditional Name: 4-[4-(4-chlorophenyl)-4-hydroxy-piperidino]-2-nitro-1-phenyl-butan-1-one Formula: C21H23ClN2O4 MolecularWeight: 402.87132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23ClN2O4/c22-18-8-6-17(7-9-18)21(26)11-14-23(15-12-21)13-10-19(24(27)28)20(25)16-4-2-1-3-5-16/h1-9,19,26H,10-15H2