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

Systemtic Name: 1-ethyl-7-(4-ethylpiperazin-1-yl)-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-7-(4-ethylpiperazin-1-yl)-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-7-(4-ethyl-1-piperazinyl)-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-7-(4-ethylpiperazin-1-yl)-6,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-7-(4-ethylpiperazino)-6,8-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C18H21F2N3O3 MolecularWeight: 365.374446

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)CC)F

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)CC)F

InChI

InChI=1S/C18H21F2N3O3/c1-3-21-5-7-23(8-6-21)16-13(19)9-11-15(14(16)20)22(4-2)10-12(17(11)24)18(25)26/h9-10H,3-8H2,1-2H3,(H,25,26)