ethyl 4-[2-[(5-azanylquinolin-2-yl)carbonylamino]-5-(2-ethoxy-2-oxidanylidene-ethoxy)-5-oxidanylidene-pentanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(5-azanylquinolin-2-yl)carbonylamino]-5-(2-ethoxy-2-oxidanylidene-ethoxy)-5-oxidanylidene-pentanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[(5-aminoquinoline-2-carbonyl)amino]-5-(2-ethoxy-2-oxo-ethoxy)-5-oxo-pentanoyl]piperazine-1-carboxylate CAS Name: 4-[2-[[(5-amino-2-quinolinyl)-oxomethyl]amino]-5-(2-ethoxy-2-oxoethoxy)-1,5-dioxopentyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(5-aminoquinoline-2-carbonyl)amino]-5-(2-ethoxy-2-oxoethoxy)-5-oxopentanoyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(5-aminoquinoline-2-carbonyl)amino]-5-(2-ethoxy-2-keto-ethoxy)-5-keto-pentanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C26H33N5O8 MolecularWeight: 543.56892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H33N5O8/c1-3-37-23(33)16-39-22(32)11-10-21(25(35)30-12-14-31(15-13-30)26(36)38-4-2)29-24(34)20-9-8-17-18(27)6-5-7-19(17)28-20/h5-9,21H,3-4,10-16,27H2,1-2H3,(H,29,34)