7-[3-(aminomethyl)-3-methyl-pyrrolidin-1-yl]-1-cyclopropyl-8-ethoxy-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[3-(aminomethyl)-3-methyl-pyrrolidin-1-yl]-1-cyclopropyl-8-ethoxy-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[3-(aminomethyl)-3-methyl-pyrrolidin-1-yl]-1-cyclopropyl-8-ethoxy-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[3-(aminomethyl)-3-methyl-1-pyrrolidinyl]-1-cyclopropyl-8-ethoxy-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[3-(aminomethyl)-3-methylpyrrolidin-1-yl]-1-cyclopropyl-8-ethoxy-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[3-(aminomethyl)-3-methyl-pyrrolidino]-1-cyclopropyl-8-ethoxy-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C21H26FN3O4 MolecularWeight: 403.447243

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC(=C1N3CCC(C3)(C)CN)F)C(=O)C(=CN2C4CC4)C(=O)O

Isomeric SMILES

CCOC1=C2C(=CC(=C1N3CCC(C3)(C)CN)F)C(=O)C(=CN2C4CC4)C(=O)O

InChI

InChI=1S/C21H26FN3O4/c1-3-29-19-16-13(18(26)14(20(27)28)9-25(16)12-4-5-12)8-15(22)17(19)24-7-6-21(2,10-23)11-24/h8-9,12H,3-7,10-11,23H2,1-2H3,(H,27,28)