5-azanyl-7-[(3R)-3-azanylazepan-1-yl]-8-chloranyl-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 5-azanyl-7-[(3R)-3-azanylazepan-1-yl]-8-chloranyl-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-7-[(3R)-3-aminoazepan-1-yl]-8-chloro-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-7-[(3R)-3-amino-1-azepanyl]-8-chloro-1-cyclopropyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-7-[(3R)-3-aminoazepan-1-yl]-8-chloro-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-7-[(3R)-3-aminoazepan-1-yl]-8-chloro-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C19H22ClFN4O3 MolecularWeight: 408.854383

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC(C1)N)C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4CC4)C(=O)O)Cl

Isomeric SMILES

C1CCN(C[C@@H](C1)N)C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4CC4)C(=O)O)Cl

InChI

InChI=1S/C19H22ClFN4O3/c20-13-16-12(18(26)11(19(27)28)8-25(16)10-4-5-10)15(23)14(21)17(13)24-6-2-1-3-9(22)7-24/h8-10H,1-7,22-23H2,(H,27,28)/t9-/m1/s1