7-[4-[2-(2-azanylethanoylamino)-1-chloranyl-ethylidene]piperidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[4-[2-(2-azanylethanoylamino)-1-chloranyl-ethylidene]piperidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[4-[2-[(2-aminoacetyl)amino]-1-chloro-ethylidene]-1-piperidyl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[4-[2-[(2-amino-1-oxoethyl)amino]-1-chloroethylidene]-1-piperidinyl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[4-[2-[(2-aminoacetyl)amino]-1-chloroethylidene]piperidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[4-[1-chloro-2-(glycylamino)ethylidene]piperidino]-1-cyclopropyl-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C23H26ClFN4O5 MolecularWeight: 492.927743

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1N3CCC(=C(CNC(=O)CN)Cl)CC3)F)C(=O)C(=CN2C4CC4)C(=O)O

Isomeric SMILES

COC1=C2C(=CC(=C1N3CCC(=C(CNC(=O)CN)Cl)CC3)F)C(=O)C(=CN2C4CC4)C(=O)O

InChI

InChI=1S/C23H26ClFN4O5/c1-34-22-19-14(21(31)15(23(32)33)11-29(19)13-2-3-13)8-17(25)20(22)28-6-4-12(5-7-28)16(24)10-27-18(30)9-26/h8,11,13H,2-7,9-10,26H2,1H3,(H,27,30)(H,32,33)