6-azanyl-7-[4-(4-ethanoylphenyl)piperazin-1-yl]-1-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6-azanyl-7-[4-(4-ethanoylphenyl)piperazin-1-yl]-1-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[4-(4-acetylphenyl)piperazin-1-yl]-6-amino-1-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[4-(4-acetylphenyl)-1-piperazinyl]-6-amino-1-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[4-(4-acetylphenyl)piperazin-1-yl]-6-amino-1-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[4-(4-acetylphenyl)piperazino]-6-amino-4-keto-1-methyl-quinoline-3-carboxylic acid Formula: C23H24N4O4 MolecularWeight: 420.46106

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C)N

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C)N

InChI

InChI=1S/C23H24N4O4/c1-14(28)15-3-5-16(6-4-15)26-7-9-27(10-8-26)21-12-20-17(11-19(21)24)22(29)18(23(30)31)13-25(20)2/h3-6,11-13H,7-10,24H2,1-2H3,(H,30,31)