1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-[(phenylmethylidene)amino]-2-pyrrolidin-1-yl-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-[(phenylmethylidene)amino]-2-pyrrolidin-1-yl-quinoline-3-carboxylic acid Openeye Name: 7-(benzylideneamino)-1-cyclopropyl-6-fluoro-4-oxo-2-pyrrolidin-1-yl-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-4-oxo-7-[(phenylmethylene)amino]-2-(1-pyrrolidinyl)-3-quinolinecarboxylic acid IUPAC Name: 7-(benzylideneamino)-1-cyclopropyl-6-fluoro-4-oxo-2-pyrrolidin-1-ylquinoline-3-carboxylic acid Traditional Name: 7-(benzalamino)-1-cyclopropyl-6-fluoro-4-keto-2-pyrrolidino-quinoline-3-carboxylic acid Formula: C24H22FN3O3 MolecularWeight: 419.448183

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C(=O)C3=CC(=C(C=C3N2C4CC4)N=CC5=CC=CC=C5)F)C(=O)O

Isomeric SMILES

C1CCN(C1)C2=C(C(=O)C3=CC(=C(C=C3N2C4CC4)N=CC5=CC=CC=C5)F)C(=O)O

InChI

InChI=1S/C24H22FN3O3/c25-18-12-17-20(13-19(18)26-14-15-6-2-1-3-7-15)28(16-8-9-16)23(27-10-4-5-11-27)21(22(17)29)24(30)31/h1-3,6-7,12-14,16H,4-5,8-11H2,(H,30,31)