7-[(4-carboxyphenyl)methyl-(6-chloranylpyridin-2-yl)amino]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[(4-carboxyphenyl)methyl-(6-chloranylpyridin-2-yl)amino]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[(4-carboxyphenyl)methyl-(6-chloro-2-pyridyl)amino]-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[(4-carboxyphenyl)methyl-(6-chloro-2-pyridinyl)amino]-1-cyclopropyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[(4-carboxyphenyl)methyl-(6-chloropyridin-2-yl)amino]-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[(4-carboxybenzyl)-(6-chloro-2-pyridyl)amino]-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C26H19ClFN3O5 MolecularWeight: 507.897563

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N(CC4=CC=C(C=C4)C(=O)O)C5=NC(=CC=C5)Cl)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N(CC4=CC=C(C=C4)C(=O)O)C5=NC(=CC=C5)Cl)F)C(=O)O

InChI

InChI=1S/C26H19ClFN3O5/c27-22-2-1-3-23(29-22)31(12-14-4-6-15(7-5-14)25(33)34)21-11-20-17(10-19(21)28)24(32)18(26(35)36)13-30(20)16-8-9-16/h1-7,10-11,13,16H,8-9,12H2,(H,33,34)(H,35,36)