4-ethoxycarbonyl-1-[2-[(4-methoxyquinolin-2-yl)carbonylamino]ethanoyl]piperazine-2-carboxylic acid

Systemtic Name: 4-ethoxycarbonyl-1-[2-[(4-methoxyquinolin-2-yl)carbonylamino]ethanoyl]piperazine-2-carboxylic acid Openeye Name: 4-ethoxycarbonyl-1-[2-[(4-methoxyquinoline-2-carbonyl)amino]acetyl]piperazine-2-carboxylic acid CAS Name: 4-ethoxycarbonyl-1-[2-[[(4-methoxy-2-quinolinyl)-oxomethyl]amino]-1-oxoethyl]-2-piperazinecarboxylic acid IUPAC Name: 4-ethoxycarbonyl-1-[2-[(4-methoxyquinoline-2-carbonyl)amino]acetyl]piperazine-2-carboxylic acid Traditional Name: 4-carbethoxy-1-[2-[(4-methoxyquinoline-2-carbonyl)amino]acetyl]piperazine-2-carboxylic acid Formula: C21H24N4O7 MolecularWeight: 444.43786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(C(C1)C(=O)O)C(=O)CNC(=O)C2=NC3=CC=CC=C3C(=C2)OC

Isomeric SMILES

CCOC(=O)N1CCN(C(C1)C(=O)O)C(=O)CNC(=O)C2=NC3=CC=CC=C3C(=C2)OC

InChI

InChI=1S/C21H24N4O7/c1-3-32-21(30)24-8-9-25(16(12-24)20(28)29)18(26)11-22-19(27)15-10-17(31-2)13-6-4-5-7-14(13)23-15/h4-7,10,16H,3,8-9,11-12H2,1-2H3,(H,22,27)(H,28,29)