8-chloranyl-1-ethenyl-6-fluoranyl-5-methyl-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid

Systemtic Name: 8-chloranyl-1-ethenyl-6-fluoranyl-5-methyl-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid Openeye Name: 8-chloro-6-fluoro-5-methyl-4-oxo-7-piperazin-1-yl-1-vinyl-quinoline-3-carboxylic acid CAS Name: 8-chloro-1-ethenyl-6-fluoro-5-methyl-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid IUPAC Name: 8-chloro-1-ethenyl-6-fluoro-5-methyl-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid Traditional Name: 8-chloro-6-fluoro-4-keto-5-methyl-7-piperazino-1-vinyl-quinoline-3-carboxylic acid Formula: C17H17ClFN3O3 MolecularWeight: 365.786583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1F)N3CCNCC3)Cl)N(C=C(C2=O)C(=O)O)C=C

Isomeric SMILES

CC1=C2C(=C(C(=C1F)N3CCNCC3)Cl)N(C=C(C2=O)C(=O)O)C=C

InChI

InChI=1S/C17H17ClFN3O3/c1-3-21-8-10(17(24)25)16(23)11-9(2)13(19)15(12(18)14(11)21)22-6-4-20-5-7-22/h3,8,20H,1,4-7H2,2H3,(H,24,25)