1-cyclopropyl-8-methyl-7-(4-methylpiperazin-1-yl)-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-8-methyl-7-(4-methylpiperazin-1-yl)-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-8-methyl-7-(4-methylpiperazin-1-yl)-6-nitro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-8-methyl-7-(4-methyl-1-piperazinyl)-6-nitro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-8-methyl-7-(4-methylpiperazin-1-yl)-6-nitro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-4-keto-8-methyl-7-(4-methylpiperazino)-6-nitro-quinoline-3-carboxylic acid Formula: C19H22N4O5 MolecularWeight: 386.40178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1N3CCN(CC3)C)[N+](=O)[O-])C(=O)C(=CN2C4CC4)C(=O)O

Isomeric SMILES

CC1=C2C(=CC(=C1N3CCN(CC3)C)[N+](=O)[O-])C(=O)C(=CN2C4CC4)C(=O)O

InChI

InChI=1S/C19H22N4O5/c1-11-16-13(18(24)14(19(25)26)10-22(16)12-3-4-12)9-15(23(27)28)17(11)21-7-5-20(2)6-8-21/h9-10,12H,3-8H2,1-2H3,(H,25,26)