7-[(3E)-3-(2-azanyl-1-chloranyl-ethylidene)piperidin-1-yl]-1-cyclopropyl-6-fluoranyl-5-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[(3E)-3-(2-azanyl-1-chloranyl-ethylidene)piperidin-1-yl]-1-cyclopropyl-6-fluoranyl-5-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[(3E)-3-(2-amino-1-chloro-ethylidene)-1-piperidyl]-1-cyclopropyl-6-fluoro-5-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[(3E)-3-(2-amino-1-chloroethylidene)-1-piperidinyl]-1-cyclopropyl-6-fluoro-5-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[(3E)-3-(2-amino-1-chloroethylidene)piperidin-1-yl]-1-cyclopropyl-6-fluoro-5-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[(3E)-3-(2-amino-1-chloro-ethylidene)piperidino]-1-cyclopropyl-6-fluoro-4-keto-5-methyl-quinoline-3-carboxylic acid Formula: C21H23ClFN3O3 MolecularWeight: 419.877023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1F)N3CCCC(=C(CN)Cl)C3)N(C=C(C2=O)C(=O)O)C4CC4

Isomeric SMILES

CC1=C2C(=CC(=C1F)N3CCC/C(=C(/CN)\Cl)/C3)N(C=C(C2=O)C(=O)O)C4CC4

InChI

InChI=1S/C21H23ClFN3O3/c1-11-18-16(26(13-4-5-13)10-14(20(18)27)21(28)29)7-17(19(11)23)25-6-2-3-12(9-25)15(22)8-24/h7,10,13H,2-6,8-9,24H2,1H3,(H,28,29)/b15-12+