7-[4-[(7-chloranyl-4-oxidanylidene-2,3-dihydrochromen-3-yl)methyl]piperazin-1-yl]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[4-[(7-chloranyl-4-oxidanylidene-2,3-dihydrochromen-3-yl)methyl]piperazin-1-yl]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[4-[(7-chloro-4-oxo-chroman-3-yl)methyl]piperazin-1-yl]-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[4-[(7-chloro-4-oxo-3,4-dihydro-2H-1-benzopyran-3-yl)methyl]-1-piperazinyl]-1-cyclopropyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[4-[(7-chloro-4-oxo-2,3-dihydrochromen-3-yl)methyl]piperazin-1-yl]-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[4-[(7-chloro-4-keto-chroman-3-yl)methyl]piperazino]-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C27H25ClFN3O5 MolecularWeight: 525.955903

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)CC5COC6=C(C5=O)C=CC(=C6)Cl)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)CC5COC6=C(C5=O)C=CC(=C6)Cl)F)C(=O)O

InChI

InChI=1S/C27H25ClFN3O5/c28-16-1-4-18-24(9-16)37-14-15(25(18)33)12-30-5-7-31(8-6-30)23-11-22-19(10-21(23)29)26(34)20(27(35)36)13-32(22)17-2-3-17/h1,4,9-11,13,15,17H,2-3,5-8,12,14H2,(H,35,36)