6-chloranyl-1-methyl-4-(4-methylpiperazin-1-yl)-2-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6-chloranyl-1-methyl-4-(4-methylpiperazin-1-yl)-2-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-chloro-1-methyl-4-(4-methylpiperazin-1-yl)-2-oxo-quinoline-3-carboxylic acid CAS Name: 6-chloro-1-methyl-4-(4-methyl-1-piperazinyl)-2-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-chloro-1-methyl-4-(4-methylpiperazin-1-yl)-2-oxoquinoline-3-carboxylic acid Traditional Name: 6-chloro-2-keto-1-methyl-4-(4-methylpiperazino)quinoline-3-carboxylic acid Formula: C16H18ClN3O3 MolecularWeight: 335.78542

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C(=O)N(C3=C2C=C(C=C3)Cl)C)C(=O)O

Isomeric SMILES

CN1CCN(CC1)C2=C(C(=O)N(C3=C2C=C(C=C3)Cl)C)C(=O)O

InChI

InChI=1S/C16H18ClN3O3/c1-18-5-7-20(8-6-18)14-11-9-10(17)3-4-12(11)19(2)15(21)13(14)16(22)23/h3-4,9H,5-8H2,1-2H3,(H,22,23)