4-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-3-nitro-1-(phenylmethyl)quinolin-2-one

Systemtic Name: 4-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-3-nitro-1-(phenylmethyl)quinolin-2-one Openeye Name: 1-benzyl-4-[4-(4-fluorobenzoyl)piperazin-1-yl]-3-nitro-quinolin-2-one CAS Name: 4-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]-3-nitro-1-(phenylmethyl)-2-quinolinone IUPAC Name: 1-benzyl-4-[4-(4-fluorobenzoyl)piperazin-1-yl]-3-nitroquinolin-2-one Traditional Name: 1-benzyl-4-[4-(4-fluorobenzoyl)piperazino]-3-nitro-carbostyril Formula: C27H23FN4O4 MolecularWeight: 486.494323

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)N(C3=CC=CC=C32)CC4=CC=CC=C4)[N+](=O)[O-])C(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)N(C3=CC=CC=C32)CC4=CC=CC=C4)[N+](=O)[O-])C(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C27H23FN4O4/c28-21-12-10-20(11-13-21)26(33)30-16-14-29(15-17-30)24-22-8-4-5-9-23(22)31(27(34)25(24)32(35)36)18-19-6-2-1-3-7-19/h1-13H,14-18H2