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

Systemtic Name: 1-cyclopropyl-8-methyl-7-(4-methyl-3-phenyl-piperazin-1-yl)-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-8-methyl-7-(4-methyl-3-phenyl-piperazin-1-yl)-6-nitro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-8-methyl-7-(4-methyl-3-phenyl-1-piperazinyl)-6-nitro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-8-methyl-7-(4-methyl-3-phenylpiperazin-1-yl)-6-nitro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-4-keto-8-methyl-7-(4-methyl-3-phenyl-piperazino)-6-nitro-quinoline-3-carboxylic acid Formula: C25H26N4O5 MolecularWeight: 462.49774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1N3CCN(C(C3)C4=CC=CC=C4)C)[N+](=O)[O-])C(=O)C(=CN2C5CC5)C(=O)O

Isomeric SMILES

CC1=C2C(=CC(=C1N3CCN(C(C3)C4=CC=CC=C4)C)[N+](=O)[O-])C(=O)C(=CN2C5CC5)C(=O)O

InChI

InChI=1S/C25H26N4O5/c1-15-22-18(24(30)19(25(31)32)13-28(22)17-8-9-17)12-20(29(33)34)23(15)27-11-10-26(2)21(14-27)16-6-4-3-5-7-16/h3-7,12-13,17,21H,8-11,14H2,1-2H3,(H,31,32)