3-[2-(1-azanylethyl)pyrrolidin-1-yl]-1-cyclopropyl-8-ethoxy-6-fluoranyl-4-oxidanylidene-2H-quinoline-3-carboxylic acid

Systemtic Name: 3-[2-(1-azanylethyl)pyrrolidin-1-yl]-1-cyclopropyl-8-ethoxy-6-fluoranyl-4-oxidanylidene-2H-quinoline-3-carboxylic acid Openeye Name: 3-[2-(1-aminoethyl)pyrrolidin-1-yl]-1-cyclopropyl-8-ethoxy-6-fluoro-4-oxo-2H-quinoline-3-carboxylic acid CAS Name: 3-[2-(1-aminoethyl)-1-pyrrolidinyl]-1-cyclopropyl-8-ethoxy-6-fluoro-4-oxo-2H-quinoline-3-carboxylic acid IUPAC Name: 3-[2-(1-aminoethyl)pyrrolidin-1-yl]-1-cyclopropyl-8-ethoxy-6-fluoro-4-oxo-2H-quinoline-3-carboxylic acid Traditional Name: 3-[2-(1-aminoethyl)pyrrolidino]-1-cyclopropyl-8-ethoxy-6-fluoro-4-keto-2H-quinoline-3-carboxylic acid Formula: C21H28FN3O4 MolecularWeight: 405.463123

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC(=C1)F)C(=O)C(CN2C3CC3)(C(=O)O)N4CCCC4C(C)N

Isomeric SMILES

CCOC1=C2C(=CC(=C1)F)C(=O)C(CN2C3CC3)(C(=O)O)N4CCCC4C(C)N

InChI

InChI=1S/C21H28FN3O4/c1-3-29-17-10-13(22)9-15-18(17)24(14-6-7-14)11-21(19(15)26,20(27)28)25-8-4-5-16(25)12(2)23/h9-10,12,14,16H,3-8,11,23H2,1-2H3,(H,27,28)