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

Systemtic Name: 1-ethenyl-6,8-bis(fluoranyl)-5-methyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6,8-difluoro-5-methyl-7-(4-methylpiperazin-1-yl)-4-oxo-1-vinyl-quinoline-3-carboxylic acid CAS Name: 1-ethenyl-6,8-difluoro-5-methyl-7-(4-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethenyl-6,8-difluoro-5-methyl-7-(4-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 6,8-difluoro-4-keto-5-methyl-7-(4-methylpiperazino)-1-vinyl-quinoline-3-carboxylic acid Formula: C18H19F2N3O3 MolecularWeight: 363.358566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1F)N3CCN(CC3)C)F)N(C=C(C2=O)C(=O)O)C=C

Isomeric SMILES

CC1=C2C(=C(C(=C1F)N3CCN(CC3)C)F)N(C=C(C2=O)C(=O)O)C=C

InChI

InChI=1S/C18H19F2N3O3/c1-4-22-9-11(18(25)26)17(24)12-10(2)13(19)16(14(20)15(12)22)23-7-5-21(3)6-8-23/h4,9H,1,5-8H2,2-3H3,(H,25,26)