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

Systemtic Name: [8-ethyl-6-methyl-3-[(4-methyl-3-oxidanyl-pyridin-2-yl)carbonylamino]-4,9-bis(oxidanylidene)-1,5-dioxonan-7-yl] 3-methylbutanoate Openeye Name: [8-ethyl-3-[(3-hydroxy-4-methyl-pyridine-2-carbonyl)amino]-6-methyl-4,9-dioxo-1,5-dioxonan-7-yl] 3-methylbutanoate CAS Name: 3-methylbutanoic acid [8-ethyl-3-[[(3-hydroxy-4-methyl-2-pyridinyl)-oxomethyl]amino]-6-methyl-4,9-dioxo-1,5-dioxonan-7-yl] ester IUPAC Name: [8-ethyl-3-[(3-hydroxy-4-methylpyridine-2-carbonyl)amino]-6-methyl-4,9-dioxo-1,5-dioxonan-7-yl] 3-methylbutanoate Traditional Name: 3-methylbutyric acid [8-ethyl-3-[(3-hydroxy-4-methyl-picolinoyl)amino]-4,9-diketo-6-methyl-1,5-dioxonan-7-yl] ester Formula: C22H30N2O8 MolecularWeight: 450.4822

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C(OC(=O)C(COC1=O)NC(=O)C2=NC=CC(=C2O)C)C)OC(=O)CC(C)C

Isomeric SMILES

CCC1C(C(OC(=O)C(COC1=O)NC(=O)C2=NC=CC(=C2O)C)C)OC(=O)CC(C)C

InChI

InChI=1S/C22H30N2O8/c1-6-14-19(32-16(25)9-11(2)3)13(5)31-22(29)15(10-30-21(14)28)24-20(27)17-18(26)12(4)7-8-23-17/h7-8,11,13-15,19,26H,6,9-10H2,1-5H3,(H,24,27)