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

Systemtic Name: 7-[(3E)-3-(2-azanyl-1-chloranyl-ethylidene)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[(3E)-3-(2-amino-1-chloro-ethylidene)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[(3E)-3-(2-amino-1-chloroethylidene)-1-pyrrolidinyl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[(3E)-3-(2-amino-1-chloroethylidene)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[(3E)-3-(2-amino-1-chloro-ethylidene)pyrrolidino]-1-cyclopropyl-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C20H21ClFN3O4 MolecularWeight: 421.849843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1N3CCC(=C(CN)Cl)C3)F)C(=O)C(=CN2C4CC4)C(=O)O

Isomeric SMILES

COC1=C2C(=CC(=C1N3CC/C(=C(/CN)\Cl)/C3)F)C(=O)C(=CN2C4CC4)C(=O)O

InChI

InChI=1S/C20H21ClFN3O4/c1-29-19-16-12(18(26)13(20(27)28)9-25(16)11-2-3-11)6-15(22)17(19)24-5-4-10(8-24)14(21)7-23/h6,9,11H,2-5,7-8,23H2,1H3,(H,27,28)/b14-10+