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

Systemtic Name: 1-[(4-fluorophenyl)methyl]-4-[4-(4-methoxyphenyl)carbonylpiperazin-1-yl]-3-nitro-quinolin-2-one Openeye Name: 1-[(4-fluorophenyl)methyl]-4-[4-(4-methoxybenzoyl)piperazin-1-yl]-3-nitro-quinolin-2-one CAS Name: 1-[(4-fluorophenyl)methyl]-4-[4-[(4-methoxyphenyl)-oxomethyl]-1-piperazinyl]-3-nitro-2-quinolinone IUPAC Name: 1-[(4-fluorophenyl)methyl]-4-[4-(4-methoxybenzoyl)piperazin-1-yl]-3-nitroquinolin-2-one Traditional Name: 1-(4-fluorobenzyl)-3-nitro-4-(4-p-anisoylpiperazino)carbostyril Formula: C28H25FN4O5 MolecularWeight: 516.520303

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C(=O)N(C4=CC=CC=C43)CC5=CC=C(C=C5)F)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C(=O)N(C4=CC=CC=C43)CC5=CC=C(C=C5)F)[N+](=O)[O-]

InChI

InChI=1S/C28H25FN4O5/c1-38-22-12-8-20(9-13-22)27(34)31-16-14-30(15-17-31)25-23-4-2-3-5-24(23)32(28(35)26(25)33(36)37)18-19-6-10-21(29)11-7-19/h2-13H,14-18H2,1H3