5-(4-ethoxycarbonylpiperazin-1-yl)-4-[[7-methyl-4-(1-oxidanyl-1-oxidanylidene-propan-2-yl)oxy-quinolin-2-yl]carbonylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-(4-ethoxycarbonylpiperazin-1-yl)-4-[[7-methyl-4-(1-oxidanyl-1-oxidanylidene-propan-2-yl)oxy-quinolin-2-yl]carbonylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-(4-ethoxycarbonylpiperazin-1-yl)-4-[[4-(2-hydroxy-1-methyl-2-oxo-ethoxy)-7-methyl-quinoline-2-carbonyl]amino]-5-oxo-pentanoic acid CAS Name: 5-(4-ethoxycarbonyl-1-piperazinyl)-4-[[[4-(1-hydroxy-1-oxopropan-2-yl)oxy-7-methyl-2-quinolinyl]-oxomethyl]amino]-5-oxopentanoic acid IUPAC Name: 5-(4-ethoxycarbonylpiperazin-1-yl)-4-[[4-(1-hydroxy-1-oxopropan-2-yl)oxy-7-methylquinoline-2-carbonyl]amino]-5-oxopentanoic acid Traditional Name: 5-(4-carbethoxypiperazino)-4-[[4-(2-hydroxy-2-keto-1-methyl-ethoxy)-7-methyl-quinoline-2-carbonyl]amino]-5-keto-valeric acid Formula: C26H32N4O9 MolecularWeight: 544.55368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(CCC(=O)O)NC(=O)C2=NC3=C(C=CC(=C3)C)C(=C2)OC(C)C(=O)O

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C(CCC(=O)O)NC(=O)C2=NC3=C(C=CC(=C3)C)C(=C2)OC(C)C(=O)O

InChI

InChI=1S/C26H32N4O9/c1-4-38-26(37)30-11-9-29(10-12-30)24(34)18(7-8-22(31)32)28-23(33)20-14-21(39-16(3)25(35)36)17-6-5-15(2)13-19(17)27-20/h5-6,13-14,16,18H,4,7-12H2,1-3H3,(H,28,33)(H,31,32)(H,35,36)