5-azanyl-7-[(3R,4S)-3-(1-azanylcyclopropyl)-4-fluoranyl-pyrrolidin-1-yl]-6-fluoranyl-1-[(1R,2S)-2-fluoranylcyclopropyl]-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid hydrochloride

Systemtic Name: 5-azanyl-7-[(3R,4S)-3-(1-azanylcyclopropyl)-4-fluoranyl-pyrrolidin-1-yl]-6-fluoranyl-1-[(1R,2S)-2-fluoranylcyclopropyl]-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid hydrochloride Openeye Name: 5-amino-7-[(3R,4S)-3-(1-aminocyclopropyl)-4-fluoro-pyrrolidin-1-yl]-6-fluoro-1-[(1R,2S)-2-fluorocyclopropyl]-8-methyl-4-oxo-quinoline-3-carboxylic acid hydrochloride CAS Name: 5-amino-7-[(3R,4S)-3-(1-aminocyclopropyl)-4-fluoro-1-pyrrolidinyl]-6-fluoro-1-[(1R,2S)-2-fluorocyclopropyl]-8-methyl-4-oxo-3-quinolinecarboxylic acid hydrochloride IUPAC Name: 5-amino-7-[(3R,4S)-3-(1-aminocyclopropyl)-4-fluoropyrrolidin-1-yl]-6-fluoro-1-[(1R,2S)-2-fluorocyclopropyl]-8-methyl-4-oxoquinoline-3-carboxylic acid hydrochloride Traditional Name: 5-amino-7-[(3R,4S)-3-(1-aminocyclopropyl)-4-fluoro-pyrrolidino]-6-fluoro-1-[(1R,2S)-2-fluorocyclopropyl]-4-keto-8-methyl-quinoline-3-carboxylic acid hydrochloride Formula: C21H24ClF3N4O3 MolecularWeight: 472.88847

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1N(C=C(C2=O)C(=O)O)C3CC3F)N)F)N4CC(C(C4)F)C5(CC5)N.Cl

Isomeric SMILES

CC1=C(C(=C(C2=C1N(C=C(C2=O)C(=O)O)[C@@H]3C[C@@H]3F)N)F)N4C[C@@H]([C@@H](C4)F)C5(CC5)N.Cl

InChI

InChI=1S/C21H23F3N4O3.ClH/c1-8-17-14(19(29)9(20(30)31)5-28(17)13-4-11(13)22)16(25)15(24)18(8)27-6-10(12(23)7-27)21(26)2-3-21;/h5,10-13H,2-4,6-7,25-26H2,1H3,(H,30,31);1H/t10-,11-,12+,13+;/m0./s1