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

Systemtic Name: 6-chloranyl-4-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-3-nitro-1-(phenylmethyl)quinolin-2-one Openeye Name: 1-benzyl-6-chloro-4-[4-(4-fluorobenzoyl)piperazin-1-yl]-3-nitro-quinolin-2-one CAS Name: 6-chloro-4-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]-3-nitro-1-(phenylmethyl)-2-quinolinone IUPAC Name: 1-benzyl-6-chloro-4-[4-(4-fluorobenzoyl)piperazin-1-yl]-3-nitroquinolin-2-one Traditional Name: 1-benzyl-6-chloro-4-[4-(4-fluorobenzoyl)piperazino]-3-nitro-carbostyril Formula: C27H22ClFN4O4 MolecularWeight: 520.939383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)N(C3=C2C=C(C=C3)Cl)CC4=CC=CC=C4)[N+](=O)[O-])C(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)N(C3=C2C=C(C=C3)Cl)CC4=CC=CC=C4)[N+](=O)[O-])C(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C27H22ClFN4O4/c28-20-8-11-23-22(16-20)24(25(33(36)37)27(35)32(23)17-18-4-2-1-3-5-18)30-12-14-31(15-13-30)26(34)19-6-9-21(29)10-7-19/h1-11,16H,12-15,17H2