ethyl 4-[2-[[4-(1-ethoxy-3-methyl-1-oxidanylidene-butan-2-yl)oxyquinolin-2-yl]carbonylamino]-5-methoxy-5-oxidanylidene-pentanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[[4-(1-ethoxy-3-methyl-1-oxidanylidene-butan-2-yl)oxyquinolin-2-yl]carbonylamino]-5-methoxy-5-oxidanylidene-pentanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[[4-(1-ethoxycarbonyl-2-methyl-propoxy)quinoline-2-carbonyl]amino]-5-methoxy-5-oxo-pentanoyl]piperazine-1-carboxylate CAS Name: 4-[2-[[[4-(1-ethoxy-3-methyl-1-oxobutan-2-yl)oxy-2-quinolinyl]-oxomethyl]amino]-5-methoxy-1,5-dioxopentyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[[4-(1-ethoxy-3-methyl-1-oxobutan-2-yl)oxyquinoline-2-carbonyl]amino]-5-methoxy-5-oxopentanoyl]piperazine-1-carboxylate Traditional Name: 4-[2-[[4-(1-carbethoxy-2-methyl-propoxy)quinoline-2-carbonyl]amino]-5-keto-5-methoxy-pentanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C30H40N4O9 MolecularWeight: 600.66

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C)C)OC1=CC(=NC2=CC=CC=C21)C(=O)NC(CCC(=O)OC)C(=O)N3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C(C)C)OC1=CC(=NC2=CC=CC=C21)C(=O)NC(CCC(=O)OC)C(=O)N3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C30H40N4O9/c1-6-41-29(38)26(19(3)4)43-24-18-23(31-21-11-9-8-10-20(21)24)27(36)32-22(12-13-25(35)40-5)28(37)33-14-16-34(17-15-33)30(39)42-7-2/h8-11,18-19,22,26H,6-7,12-17H2,1-5H3,(H,32,36)