1-cyclopropyl-5-ethenyl-7-(4-ethylpiperazin-1-yl)-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-5-ethenyl-7-(4-ethylpiperazin-1-yl)-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-(4-ethylpiperazin-1-yl)-6,8-difluoro-4-oxo-5-vinyl-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-5-ethenyl-7-(4-ethyl-1-piperazinyl)-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-5-ethenyl-7-(4-ethylpiperazin-1-yl)-6,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-(4-ethylpiperazino)-6,8-difluoro-4-keto-5-vinyl-quinoline-3-carboxylic acid Formula: C21H23F2N3O3 MolecularWeight: 403.422426

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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)C4CC4)C=C)F

Isomeric SMILES

CCN1CCN(CC1)C2=C(C(=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4CC4)C=C)F

InChI

InChI=1S/C21H23F2N3O3/c1-3-13-15-18(26(12-5-6-12)11-14(20(15)27)21(28)29)17(23)19(16(13)22)25-9-7-24(4-2)8-10-25/h3,11-12H,1,4-10H2,2H3,(H,28,29)