7-(3-azanylpyrrolidin-1-yl)-8-chloranyl-1-cyclopropyl-6-fluoranyl-2-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(3-azanylpyrrolidin-1-yl)-8-chloranyl-1-cyclopropyl-6-fluoranyl-2-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3-aminopyrrolidin-1-yl)-8-chloro-1-cyclopropyl-6-fluoro-2-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3-amino-1-pyrrolidinyl)-8-chloro-1-cyclopropyl-6-fluoro-2-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3-aminopyrrolidin-1-yl)-8-chloro-1-cyclopropyl-6-fluoro-2-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3-aminopyrrolidino)-8-chloro-1-cyclopropyl-6-fluoro-4-keto-2-methoxy-quinoline-3-carboxylic acid Formula: C18H19ClFN3O4 MolecularWeight: 395.812563

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=O)C2=CC(=C(C(=C2N1C3CC3)Cl)N4CCC(C4)N)F)C(=O)O

Isomeric SMILES

COC1=C(C(=O)C2=CC(=C(C(=C2N1C3CC3)Cl)N4CCC(C4)N)F)C(=O)O

InChI

InChI=1S/C18H19ClFN3O4/c1-27-17-12(18(25)26)16(24)10-6-11(20)15(22-5-4-8(21)7-22)13(19)14(10)23(17)9-2-3-9/h6,8-9H,2-5,7,21H2,1H3,(H,25,26)