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

Systemtic Name: ethyl 4-[2-[(4-ethoxyquinolin-2-yl)carbonylamino]-5-oxidanylidene-5-phenylmethoxy-pentanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[5-benzyloxy-2-[(4-ethoxyquinoline-2-carbonyl)amino]-5-oxo-pentanoyl]piperazine-1-carboxylate CAS Name: 4-[2-[[(4-ethoxy-2-quinolinyl)-oxomethyl]amino]-1,5-dioxo-5-phenylmethoxypentyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(4-ethoxyquinoline-2-carbonyl)amino]-5-oxo-5-phenylmethoxypentanoyl]piperazine-1-carboxylate Traditional Name: 4-[5-benzoxy-2-[(4-ethoxyquinoline-2-carbonyl)amino]-5-keto-pentanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C31H36N4O7 MolecularWeight: 576.64014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=NC2=CC=CC=C21)C(=O)NC(CCC(=O)OCC3=CC=CC=C3)C(=O)N4CCN(CC4)C(=O)OCC

Isomeric SMILES

CCOC1=CC(=NC2=CC=CC=C21)C(=O)NC(CCC(=O)OCC3=CC=CC=C3)C(=O)N4CCN(CC4)C(=O)OCC

InChI

InChI=1S/C31H36N4O7/c1-3-40-27-20-26(32-24-13-9-8-12-23(24)27)29(37)33-25(14-15-28(36)42-21-22-10-6-5-7-11-22)30(38)34-16-18-35(19-17-34)31(39)41-4-2/h5-13,20,25H,3-4,14-19,21H2,1-2H3,(H,33,37)