1-cyclopropyl-5,6-bis(fluoranyl)-7-(4-methanoylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-5,6-bis(fluoranyl)-7-(4-methanoylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-5,6-difluoro-7-(4-formylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-5,6-difluoro-7-(4-formyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-5,6-difluoro-7-(4-formylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-5,6-difluoro-7-(4-formylpiperazino)-4-keto-quinoline-3-carboxylic acid Formula: C18H17F2N3O4 MolecularWeight: 377.342086

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=C(C(=C(C=C32)N4CCN(CC4)C=O)F)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=C(C(=C(C=C32)N4CCN(CC4)C=O)F)F)C(=O)O

InChI

InChI=1S/C18H17F2N3O4/c19-15-13(22-5-3-21(9-24)4-6-22)7-12-14(16(15)20)17(25)11(18(26)27)8-23(12)10-1-2-10/h7-10H,1-6H2,(H,26,27)