7-(4-acetamido-3,3-dimethyl-piperidin-1-yl)-5-azanyl-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(4-acetamido-3,3-dimethyl-piperidin-1-yl)-5-azanyl-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(4-acetamido-3,3-dimethyl-1-piperidyl)-5-amino-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(4-acetamido-3,3-dimethyl-1-piperidinyl)-5-amino-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(4-acetamido-3,3-dimethylpiperidin-1-yl)-5-amino-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(4-acetamido-3,3-dimethyl-piperidino)-5-amino-1-cyclopropyl-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C23H29FN4O5 MolecularWeight: 460.498563

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1CCN(CC1(C)C)C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4CC4)C(=O)O)OC

Isomeric SMILES

CC(=O)NC1CCN(CC1(C)C)C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4CC4)C(=O)O)OC

InChI

InChI=1S/C23H29FN4O5/c1-11(29)26-14-7-8-27(10-23(14,2)3)19-16(24)17(25)15-18(21(19)33-4)28(12-5-6-12)9-13(20(15)30)22(31)32/h9,12,14H,5-8,10,25H2,1-4H3,(H,26,29)(H,31,32)