7-[4-(2-azanyl-1-chloranyl-ethylidene)piperidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methoxy-5-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[4-(2-azanyl-1-chloranyl-ethylidene)piperidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methoxy-5-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[4-(2-amino-1-chloro-ethylidene)-1-piperidyl]-1-cyclopropyl-6-fluoro-8-methoxy-5-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[4-(2-amino-1-chloroethylidene)-1-piperidinyl]-1-cyclopropyl-6-fluoro-8-methoxy-5-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[4-(2-amino-1-chloroethylidene)piperidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-5-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[4-(2-amino-1-chloro-ethylidene)piperidino]-1-cyclopropyl-6-fluoro-4-keto-8-methoxy-5-methyl-quinoline-3-carboxylic acid Formula: C22H25ClFN3O4 MolecularWeight: 449.903003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1F)N3CCC(=C(CN)Cl)CC3)OC)N(C=C(C2=O)C(=O)O)C4CC4

Isomeric SMILES

CC1=C2C(=C(C(=C1F)N3CCC(=C(CN)Cl)CC3)OC)N(C=C(C2=O)C(=O)O)C4CC4

InChI

InChI=1S/C22H25ClFN3O4/c1-11-16-18(27(13-3-4-13)10-14(20(16)28)22(29)30)21(31-2)19(17(11)24)26-7-5-12(6-8-26)15(23)9-25/h10,13H,3-9,25H2,1-2H3,(H,29,30)