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

Systemtic Name: ethyl 4-[5-ethoxy-2-[[4-(1-ethoxycarbonylcyclobutyl)oxyquinolin-2-yl]carbonylamino]-5-oxidanylidene-pentanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[5-ethoxy-2-[[4-(1-ethoxycarbonylcyclobutoxy)quinoline-2-carbonyl]amino]-5-oxo-pentanoyl]piperazine-1-carboxylate CAS Name: 4-[5-ethoxy-2-[[[4-(1-ethoxycarbonylcyclobutyl)oxy-2-quinolinyl]-oxomethyl]amino]-1,5-dioxopentyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-ethoxy-2-[[4-(1-ethoxycarbonylcyclobutyl)oxyquinoline-2-carbonyl]amino]-5-oxopentanoyl]piperazine-1-carboxylate Traditional Name: 4-[2-[[4-(1-carbethoxycyclobutoxy)quinoline-2-carbonyl]amino]-5-ethoxy-5-keto-pentanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C31H40N4O9 MolecularWeight: 612.6707

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C(=O)N1CCN(CC1)C(=O)OCC)NC(=O)C2=NC3=CC=CC=C3C(=C2)OC4(CCC4)C(=O)OCC

Isomeric SMILES

CCOC(=O)CCC(C(=O)N1CCN(CC1)C(=O)OCC)NC(=O)C2=NC3=CC=CC=C3C(=C2)OC4(CCC4)C(=O)OCC

InChI

InChI=1S/C31H40N4O9/c1-4-41-26(36)13-12-23(28(38)34-16-18-35(19-17-34)30(40)43-6-3)33-27(37)24-20-25(21-10-7-8-11-22(21)32-24)44-31(14-9-15-31)29(39)42-5-2/h7-8,10-11,20,23H,4-6,9,12-19H2,1-3H3,(H,33,37)