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

Systemtic Name: 6-chloranyl-4-[4-(4-methoxyphenyl)carbonylpiperazin-1-yl]-3-nitro-1-(phenylmethyl)quinolin-2-one Openeye Name: 1-benzyl-6-chloro-4-[4-(4-methoxybenzoyl)piperazin-1-yl]-3-nitro-quinolin-2-one CAS Name: 6-chloro-4-[4-[(4-methoxyphenyl)-oxomethyl]-1-piperazinyl]-3-nitro-1-(phenylmethyl)-2-quinolinone IUPAC Name: 1-benzyl-6-chloro-4-[4-(4-methoxybenzoyl)piperazin-1-yl]-3-nitroquinolin-2-one Traditional Name: 1-benzyl-6-chloro-3-nitro-4-(4-p-anisoylpiperazino)carbostyril Formula: C28H25ClN4O5 MolecularWeight: 532.9749

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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=C3C=C(C=C4)Cl)CC5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C(=O)N(C4=C3C=C(C=C4)Cl)CC5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C28H25ClN4O5/c1-38-22-10-7-20(8-11-22)27(34)31-15-13-30(14-16-31)25-23-17-21(29)9-12-24(23)32(28(35)26(25)33(36)37)18-19-5-3-2-4-6-19/h2-12,17H,13-16,18H2,1H3