[8-ethyl-6-methyl-3-[(6-methyl-3-oxidanyl-pyridin-2-yl)carbonylamino]-4,9-bis(oxidanylidene)-1,5-dioxonan-7-yl] 2-methylpropanoate

Systemtic Name: [8-ethyl-6-methyl-3-[(6-methyl-3-oxidanyl-pyridin-2-yl)carbonylamino]-4,9-bis(oxidanylidene)-1,5-dioxonan-7-yl] 2-methylpropanoate Openeye Name: [8-ethyl-3-[(3-hydroxy-6-methyl-pyridine-2-carbonyl)amino]-6-methyl-4,9-dioxo-1,5-dioxonan-7-yl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [8-ethyl-3-[[(3-hydroxy-6-methyl-2-pyridinyl)-oxomethyl]amino]-6-methyl-4,9-dioxo-1,5-dioxonan-7-yl] ester IUPAC Name: [8-ethyl-3-[(3-hydroxy-6-methylpyridine-2-carbonyl)amino]-6-methyl-4,9-dioxo-1,5-dioxonan-7-yl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [8-ethyl-3-[(3-hydroxy-6-methyl-picolinoyl)amino]-4,9-diketo-6-methyl-1,5-dioxonan-7-yl] ester Formula: C21H28N2O8 MolecularWeight: 436.45562

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C(OC(=O)C(COC1=O)NC(=O)C2=C(C=CC(=N2)C)O)C)OC(=O)C(C)C

Isomeric SMILES

CCC1C(C(OC(=O)C(COC1=O)NC(=O)C2=C(C=CC(=N2)C)O)C)OC(=O)C(C)C

InChI

InChI=1S/C21H28N2O8/c1-6-13-17(31-19(26)10(2)3)12(5)30-21(28)14(9-29-20(13)27)23-18(25)16-15(24)8-7-11(4)22-16/h7-8,10,12-14,17,24H,6,9H2,1-5H3,(H,23,25)