7-[3-(2-azanylpropan-2-yl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid hydrochloride

Systemtic Name: 7-[3-(2-azanylpropan-2-yl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid hydrochloride Openeye Name: 7-[3-(1-amino-1-methyl-ethyl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid hydrochloride CAS Name: 7-[3-(2-aminopropan-2-yl)-1-pyrrolidinyl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-3-quinolinecarboxylic acid hydrochloride IUPAC Name: 7-[3-(2-aminopropan-2-yl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid hydrochloride Traditional Name: 7-[3-(1-amino-1-methyl-ethyl)pyrrolidino]-1-cyclopropyl-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylic acid hydrochloride Formula: C21H27ClFN3O4 MolecularWeight: 439.908183

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1CCN(C1)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)C4CC4)F)N.Cl

Isomeric SMILES

CC(C)(C1CCN(C1)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)C4CC4)F)N.Cl

InChI

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