[2-[[7-ethyl-9-methyl-8-(2-methylpropanoyloxy)-2,6-bis(oxidanylidene)-1,5-dioxonan-3-yl]carbamoyl]-4-methyl-pyridin-3-yl] 4-(trichloromethyloxy)benzoate

Systemtic Name: [2-[[7-ethyl-9-methyl-8-(2-methylpropanoyloxy)-2,6-bis(oxidanylidene)-1,5-dioxonan-3-yl]carbamoyl]-4-methyl-pyridin-3-yl] 4-(trichloromethyloxy)benzoate Openeye Name: [2-[[7-ethyl-9-methyl-8-(2-methylpropanoyloxy)-2,6-dioxo-1,5-dioxonan-3-yl]carbamoyl]-4-methyl-3-pyridyl] 4-(trichloromethoxy)benzoate CAS Name: 4-(trichloromethoxy)benzoic acid [2-[[[7-ethyl-9-methyl-8-(2-methyl-1-oxopropoxy)-2,6-dioxo-1,5-dioxonan-3-yl]amino]-oxomethyl]-4-methyl-3-pyridinyl] ester IUPAC Name: [2-[[7-ethyl-9-methyl-8-(2-methylpropanoyloxy)-2,6-dioxo-1,5-dioxonan-3-yl]carbamoyl]-4-methylpyridin-3-yl] 4-(trichloromethoxy)benzoate Traditional Name: 4-(trichloromethoxy)benzoic acid [2-[(7-ethyl-8-isobutyryloxy-2,6-diketo-9-methyl-1,5-dioxonan-3-yl)carbamoyl]-4-methyl-3-pyridyl] ester Formula: C29H31Cl3N2O10 MolecularWeight: 673.92284

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C(OC(=O)C(COC1=O)NC(=O)C2=NC=CC(=C2OC(=O)C3=CC=C(C=C3)OC(Cl)(Cl)Cl)C)C)OC(=O)C(C)C

Isomeric SMILES

CCC1C(C(OC(=O)C(COC1=O)NC(=O)C2=NC=CC(=C2OC(=O)C3=CC=C(C=C3)OC(Cl)(Cl)Cl)C)C)OC(=O)C(C)C

InChI

InChI=1S/C29H31Cl3N2O10/c1-6-19-23(43-25(36)14(2)3)16(5)41-28(39)20(13-40-27(19)38)34-24(35)21-22(15(4)11-12-33-21)42-26(37)17-7-9-18(10-8-17)44-29(30,31)32/h7-12,14,16,19-20,23H,6,13H2,1-5H3,(H,34,35)