ethyl 7-[4-(4-ethanoylphenyl)piperazin-1-yl]-1-methyl-6-nitro-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 7-[4-(4-ethanoylphenyl)piperazin-1-yl]-1-methyl-6-nitro-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 7-[4-(4-acetylphenyl)piperazin-1-yl]-1-methyl-6-nitro-4-oxo-quinoline-3-carboxylate CAS Name: 7-[4-(4-acetylphenyl)-1-piperazinyl]-1-methyl-6-nitro-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-[4-(4-acetylphenyl)piperazin-1-yl]-1-methyl-6-nitro-4-oxoquinoline-3-carboxylate Traditional Name: 7-[4-(4-acetylphenyl)piperazino]-4-keto-1-methyl-6-nitro-quinoline-3-carboxylic acid ethyl ester Formula: C25H26N4O6 MolecularWeight: 478.49714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)[N+](=O)[O-])N3CCN(CC3)C4=CC=C(C=C4)C(=O)C)C

Isomeric SMILES

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)[N+](=O)[O-])N3CCN(CC3)C4=CC=C(C=C4)C(=O)C)C

InChI

InChI=1S/C25H26N4O6/c1-4-35-25(32)20-15-26(3)21-14-22(23(29(33)34)13-19(21)24(20)31)28-11-9-27(10-12-28)18-7-5-17(6-8-18)16(2)30/h5-8,13-15H,4,9-12H2,1-3H3