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

Systemtic Name: 4-[(5-acetamidoquinolin-2-yl)carbonylamino]-5-(4-ethoxycarbonylpiperazin-1-yl)-5-oxidanylidene-pentanoic acid Openeye Name: 4-[(5-acetamidoquinoline-2-carbonyl)amino]-5-(4-ethoxycarbonylpiperazin-1-yl)-5-oxo-pentanoic acid CAS Name: 4-[[(5-acetamido-2-quinolinyl)-oxomethyl]amino]-5-(4-ethoxycarbonyl-1-piperazinyl)-5-oxopentanoic acid IUPAC Name: 4-[(5-acetamidoquinoline-2-carbonyl)amino]-5-(4-ethoxycarbonylpiperazin-1-yl)-5-oxopentanoic acid Traditional Name: 4-[(5-acetamidoquinoline-2-carbonyl)amino]-5-(4-carbethoxypiperazino)-5-keto-valeric acid Formula: C24H29N5O7 MolecularWeight: 499.51636

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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=C2)C(=CC=C3)NC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C24H29N5O7/c1-3-36-24(35)29-13-11-28(12-14-29)23(34)20(9-10-21(31)32)27-22(33)19-8-7-16-17(25-15(2)30)5-4-6-18(16)26-19/h4-8,20H,3,9-14H2,1-2H3,(H,25,30)(H,27,33)(H,31,32)