1-cyclopropyl-7-[(4,4-diethoxy-2,2-dimethyl-butyl)amino]-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-7-[(4,4-diethoxy-2,2-dimethyl-butyl)amino]-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-[(4,4-diethoxy-2,2-dimethyl-butyl)amino]-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-[(4,4-diethoxy-2,2-dimethylbutyl)amino]-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-[(4,4-diethoxy-2,2-dimethylbutyl)amino]-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-[(4,4-diethoxy-2,2-dimethyl-butyl)amino]-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C23H31FN2O5 MolecularWeight: 434.501043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC(C)(C)CNC1=C(C=C2C(=C1)N(C=C(C2=O)C(=O)O)C3CC3)F)OCC

Isomeric SMILES

CCOC(CC(C)(C)CNC1=C(C=C2C(=C1)N(C=C(C2=O)C(=O)O)C3CC3)F)OCC

InChI

InChI=1S/C23H31FN2O5/c1-5-30-20(31-6-2)11-23(3,4)13-25-18-10-19-15(9-17(18)24)21(27)16(22(28)29)12-26(19)14-7-8-14/h9-10,12,14,20,25H,5-8,11,13H2,1-4H3,(H,28,29)