7-(3-bromanylprop-1-ynyl)-1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(3-bromanylprop-1-ynyl)-1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3-bromoprop-1-ynyl)-1-cyclopropyl-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3-bromoprop-1-ynyl)-1-cyclopropyl-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3-bromoprop-1-ynyl)-1-cyclopropyl-6,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3-bromoprop-1-ynyl)-1-cyclopropyl-6,8-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C16H10BrF2NO3 MolecularWeight: 382.156306

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C(=C32)F)C#CCBr)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C(=C32)F)C#CCBr)F)C(=O)O

InChI

InChI=1S/C16H10BrF2NO3/c17-5-1-2-9-12(18)6-10-14(13(9)19)20(8-3-4-8)7-11(15(10)21)16(22)23/h6-8H,3-5H2,(H,22,23)