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

Systemtic Name: 5-azanyl-7-[(3R,4S)-3-azanyl-4-methoxy-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-7-[(3R,4S)-3-amino-4-methoxy-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-7-[(3R,4S)-3-amino-4-methoxy-1-pyrrolidinyl]-1-cyclopropyl-6-fluoro-8-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-7-[(3R,4S)-3-amino-4-methoxypyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-7-[(3R,4S)-3-amino-4-methoxy-pyrrolidino]-1-cyclopropyl-6-fluoro-4-keto-8-methyl-quinoline-3-carboxylic acid Formula: C19H23FN4O4 MolecularWeight: 390.408723

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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)F)N4CC(C(C4)OC)N

Isomeric SMILES

CC1=C(C(=C(C2=C1N(C=C(C2=O)C(=O)O)C3CC3)N)F)N4C[C@H]([C@H](C4)OC)N

InChI

InChI=1S/C19H23FN4O4/c1-8-16-13(18(25)10(19(26)27)5-24(16)9-3-4-9)15(22)14(20)17(8)23-6-11(21)12(7-23)28-2/h5,9,11-12H,3-4,6-7,21-22H2,1-2H3,(H,26,27)/t11-,12+/m1/s1