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

Systemtic Name: 4-[4-(4-methoxyphenyl)carbonylpiperazin-1-yl]-6-methyl-3-nitro-1-(phenylmethyl)quinolin-2-one Openeye Name: 1-benzyl-4-[4-(4-methoxybenzoyl)piperazin-1-yl]-6-methyl-3-nitro-quinolin-2-one CAS Name: 4-[4-[(4-methoxyphenyl)-oxomethyl]-1-piperazinyl]-6-methyl-3-nitro-1-(phenylmethyl)-2-quinolinone IUPAC Name: 1-benzyl-4-[4-(4-methoxybenzoyl)piperazin-1-yl]-6-methyl-3-nitroquinolin-2-one Traditional Name: 1-benzyl-6-methyl-3-nitro-4-(4-p-anisoylpiperazino)carbostyril Formula: C29H28N4O5 MolecularWeight: 512.55642

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C29H28N4O5/c1-20-8-13-25-24(18-20)26(27(33(36)37)29(35)32(25)19-21-6-4-3-5-7-21)30-14-16-31(17-15-30)28(34)22-9-11-23(38-2)12-10-22/h3-13,18H,14-17,19H2,1-2H3