7-[(3S)-3-azanylpyrrolidin-1-yl]-1-cyclopropyl-5-(dimethylamino)-6-fluoranyl-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[(3S)-3-azanylpyrrolidin-1-yl]-1-cyclopropyl-5-(dimethylamino)-6-fluoranyl-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[(3S)-3-aminopyrrolidin-1-yl]-1-cyclopropyl-5-(dimethylamino)-6-fluoro-8-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[(3S)-3-amino-1-pyrrolidinyl]-1-cyclopropyl-5-(dimethylamino)-6-fluoro-8-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[(3S)-3-aminopyrrolidin-1-yl]-1-cyclopropyl-5-(dimethylamino)-6-fluoro-8-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[(3S)-3-aminopyrrolidino]-1-cyclopropyl-5-(dimethylamino)-6-fluoro-4-keto-8-methyl-quinoline-3-carboxylic acid Formula: C20H25FN4O3 MolecularWeight: 388.435903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1N(C=C(C2=O)C(=O)O)C3CC3)N(C)C)F)N4CCC(C4)N

Isomeric SMILES

CC1=C(C(=C(C2=C1N(C=C(C2=O)C(=O)O)C3CC3)N(C)C)F)N4CC[C@@H](C4)N

InChI

InChI=1S/C20H25FN4O3/c1-10-16-14(19(26)13(20(27)28)9-25(16)12-4-5-12)18(23(2)3)15(21)17(10)24-7-6-11(22)8-24/h9,11-12H,4-8,22H2,1-3H3,(H,27,28)/t11-/m0/s1