5-(4-ethoxycarbonylpiperazin-1-yl)-5-oxidanylidene-4-[[4-(2-oxidanylideneoxolan-3-yl)oxyquinolin-2-yl]carbonylamino]pentanoic acid

Systemtic Name: 5-(4-ethoxycarbonylpiperazin-1-yl)-5-oxidanylidene-4-[[4-(2-oxidanylideneoxolan-3-yl)oxyquinolin-2-yl]carbonylamino]pentanoic acid Openeye Name: 5-(4-ethoxycarbonylpiperazin-1-yl)-5-oxo-4-[[4-(2-oxotetrahydrofuran-3-yl)oxyquinoline-2-carbonyl]amino]pentanoic acid CAS Name: 5-(4-ethoxycarbonyl-1-piperazinyl)-5-oxo-4-[[oxo-[4-[(2-oxo-3-oxolanyl)oxy]-2-quinolinyl]methyl]amino]pentanoic acid IUPAC Name: 5-(4-ethoxycarbonylpiperazin-1-yl)-5-oxo-4-[[4-(2-oxooxolan-3-yl)oxyquinoline-2-carbonyl]amino]pentanoic acid Traditional Name: 5-(4-carbethoxypiperazino)-5-keto-4-[[4-(2-ketotetrahydrofuran-3-yl)oxyquinoline-2-carbonyl]amino]valeric acid Formula: C26H30N4O9 MolecularWeight: 542.5378

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(CCC(=O)O)NC(=O)C2=NC3=CC=CC=C3C(=C2)OC4CCOC4=O

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C(CCC(=O)O)NC(=O)C2=NC3=CC=CC=C3C(=C2)OC4CCOC4=O

InChI

InChI=1S/C26H30N4O9/c1-2-37-26(36)30-12-10-29(11-13-30)24(34)18(7-8-22(31)32)28-23(33)19-15-21(39-20-9-14-38-25(20)35)16-5-3-4-6-17(16)27-19/h3-6,15,18,20H,2,7-14H2,1H3,(H,28,33)(H,31,32)