2-[bis(4-fluorophenyl)methyl]-1-[(5-nitro-2-oxidanyl-phenyl)methyl]piperidin-4-one

Systemtic Name: 2-[bis(4-fluorophenyl)methyl]-1-[(5-nitro-2-oxidanyl-phenyl)methyl]piperidin-4-one Openeye Name: 2-[bis(4-fluorophenyl)methyl]-1-[(2-hydroxy-5-nitro-phenyl)methyl]piperidin-4-one CAS Name: 2-[bis(4-fluorophenyl)methyl]-1-[(2-hydroxy-5-nitrophenyl)methyl]-4-piperidinone IUPAC Name: 2-[bis(4-fluorophenyl)methyl]-1-[(2-hydroxy-5-nitrophenyl)methyl]piperidin-4-one Traditional Name: 2-[bis(4-fluorophenyl)methyl]-1-(2-hydroxy-5-nitro-benzyl)-4-piperidone Formula: C25H22F2N2O4 MolecularWeight: 452.449986

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CC1=O)C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)CC4=C(C=CC(=C4)[N+](=O)[O-])O

Isomeric SMILES

C1CN(C(CC1=O)C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)CC4=C(C=CC(=C4)[N+](=O)[O-])O

InChI

InChI=1S/C25H22F2N2O4/c26-19-5-1-16(2-6-19)25(17-3-7-20(27)8-4-17)23-14-22(30)11-12-28(23)15-18-13-21(29(32)33)9-10-24(18)31/h1-10,13,23,25,31H,11-12,14-15H2