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

Systemtic Name: 4-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-6-methyl-3-nitro-1-(phenylmethyl)quinolin-2-one Openeye Name: 1-benzyl-4-[4-(4-fluorobenzoyl)piperazin-1-yl]-6-methyl-3-nitro-quinolin-2-one CAS Name: 4-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]-6-methyl-3-nitro-1-(phenylmethyl)-2-quinolinone IUPAC Name: 1-benzyl-4-[4-(4-fluorobenzoyl)piperazin-1-yl]-6-methyl-3-nitroquinolin-2-one Traditional Name: 1-benzyl-4-[4-(4-fluorobenzoyl)piperazino]-6-methyl-3-nitro-carbostyril Formula: C28H25FN4O4 MolecularWeight: 500.520903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)C(=C2N3CCN(CC3)C(=O)C4=CC=C(C=C4)F)[N+](=O)[O-])CC5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)C(=C2N3CCN(CC3)C(=O)C4=CC=C(C=C4)F)[N+](=O)[O-])CC5=CC=CC=C5

InChI

InChI=1S/C28H25FN4O4/c1-19-7-12-24-23(17-19)25(26(33(36)37)28(35)32(24)18-20-5-3-2-4-6-20)30-13-15-31(16-14-30)27(34)21-8-10-22(29)11-9-21/h2-12,17H,13-16,18H2,1H3