5-(4-ethoxycarbonylpiperazin-1-yl)-5-oxidanylidene-4-[(4-oxidanylidene-1H-quinolin-2-yl)carbonylamino]pentanoic acid

Systemtic Name: 5-(4-ethoxycarbonylpiperazin-1-yl)-5-oxidanylidene-4-[(4-oxidanylidene-1H-quinolin-2-yl)carbonylamino]pentanoic acid Openeye Name: 5-(4-ethoxycarbonylpiperazin-1-yl)-5-oxo-4-[(4-oxo-1H-quinoline-2-carbonyl)amino]pentanoic acid CAS Name: 5-(4-ethoxycarbonyl-1-piperazinyl)-5-oxo-4-[[oxo-(4-oxo-1H-quinolin-2-yl)methyl]amino]pentanoic acid IUPAC Name: 5-(4-ethoxycarbonylpiperazin-1-yl)-5-oxo-4-[(4-oxo-1H-quinoline-2-carbonyl)amino]pentanoic acid Traditional Name: 5-(4-carbethoxypiperazino)-5-keto-4-[(4-keto-1H-quinoline-2-carbonyl)amino]valeric acid Formula: C22H26N4O7 MolecularWeight: 458.46444

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(CCC(=O)O)NC(=O)C2=CC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C(CCC(=O)O)NC(=O)C2=CC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C22H26N4O7/c1-2-33-22(32)26-11-9-25(10-12-26)21(31)16(7-8-19(28)29)24-20(30)17-13-18(27)14-5-3-4-6-15(14)23-17/h3-6,13,16H,2,7-12H2,1H3,(H,23,27)(H,24,30)(H,28,29)