1-cyclopropyl-7-(3,5-dimethylpiperazin-1-yl)-8-ethoxy-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-7-(3,5-dimethylpiperazin-1-yl)-8-ethoxy-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-(3,5-dimethylpiperazin-1-yl)-8-ethoxy-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-(3,5-dimethyl-1-piperazinyl)-8-ethoxy-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-(3,5-dimethylpiperazin-1-yl)-8-ethoxy-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-(3,5-dimethylpiperazino)-8-ethoxy-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C21H26FN3O4 MolecularWeight: 403.447243

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC(=C1N3CC(NC(C3)C)C)F)C(=O)C(=CN2C4CC4)C(=O)O

Isomeric SMILES

CCOC1=C2C(=CC(=C1N3CC(NC(C3)C)C)F)C(=O)C(=CN2C4CC4)C(=O)O

InChI

InChI=1S/C21H26FN3O4/c1-4-29-20-17-14(19(26)15(21(27)28)10-25(17)13-5-6-13)7-16(22)18(20)24-8-11(2)23-12(3)9-24/h7,10-13,23H,4-6,8-9H2,1-3H3,(H,27,28)