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

Systemtic Name: 7-[4-(2-azanyl-1-chloranyl-ethylidene)piperidin-1-yl]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[4-(2-amino-1-chloro-ethylidene)-1-piperidyl]-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[4-(2-amino-1-chloroethylidene)-1-piperidinyl]-1-cyclopropyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[4-(2-amino-1-chloroethylidene)piperidin-1-yl]-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[4-(2-amino-1-chloro-ethylidene)piperidino]-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C20H21ClFN3O3 MolecularWeight: 405.850443

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCC(=C(CN)Cl)CC4)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCC(=C(CN)Cl)CC4)F)C(=O)O

InChI

InChI=1S/C20H21ClFN3O3/c21-15(9-23)11-3-5-24(6-4-11)18-8-17-13(7-16(18)22)19(26)14(20(27)28)10-25(17)12-1-2-12/h7-8,10,12H,1-6,9,23H2,(H,27,28)