7-(2-bromoethylamino)-1-ethyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(2-bromoethylamino)-1-ethyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(2-bromoethylamino)-1-ethyl-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(2-bromoethylamino)-1-ethyl-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(2-bromoethylamino)-1-ethyl-6,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(2-bromoethylamino)-1-ethyl-6,8-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C14H13BrF2N2O3 MolecularWeight: 375.165426

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C(=C21)F)NCCBr)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C(=C21)F)NCCBr)F)C(=O)O

InChI

InChI=1S/C14H13BrF2N2O3/c1-2-19-6-8(14(21)22)13(20)7-5-9(16)11(18-4-3-15)10(17)12(7)19/h5-6,18H,2-4H2,1H3,(H,21,22)