7-(3-azanyl-4-methoxy-pyrrolidin-1-yl)-6-fluoranyl-1-(2-fluoranylethyl)-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(3-azanyl-4-methoxy-pyrrolidin-1-yl)-6-fluoranyl-1-(2-fluoranylethyl)-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3-amino-4-methoxy-pyrrolidin-1-yl)-6-fluoro-1-(2-fluoroethyl)-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3-amino-4-methoxy-1-pyrrolidinyl)-6-fluoro-1-(2-fluoroethyl)-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3-amino-4-methoxypyrrolidin-1-yl)-6-fluoro-1-(2-fluoroethyl)-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3-amino-4-methoxy-pyrrolidino)-6-fluoro-1-(2-fluoroethyl)-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C18H21F2N3O5 MolecularWeight: 397.373246

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Descriptors Computed from Structure

Canonical SMILES:

COC1CN(CC1N)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)CCF)F

Isomeric SMILES

COC1CN(CC1N)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)CCF)F

InChI

InChI=1S/C18H21F2N3O5/c1-27-13-8-23(7-12(13)21)15-11(20)5-9-14(17(15)28-2)22(4-3-19)6-10(16(9)24)18(25)26/h5-6,12-13H,3-4,7-8,21H2,1-2H3,(H,25,26)