ethyl 2-ethanoyl-6-(3-methyl-1,2-oxazol-5-yl)-5,7-bis(oxidanylidene)octanoate

Systemtic Name: ethyl 2-ethanoyl-6-(3-methyl-1,2-oxazol-5-yl)-5,7-bis(oxidanylidene)octanoate Openeye Name: ethyl 2-acetyl-6-(3-methylisoxazol-5-yl)-5,7-dioxo-octanoate CAS Name: 2-acetyl-6-(3-methyl-5-isoxazolyl)-5,7-dioxooctanoic acid ethyl ester IUPAC Name: ethyl 2-acetyl-6-(3-methyl-1,2-oxazol-5-yl)-5,7-dioxooctanoate Traditional Name: 2-acetyl-5,7-diketo-6-(3-methylisoxazol-5-yl)caprylic acid ethyl ester Formula: C16H21NO6 MolecularWeight: 323.34104

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC(=O)C(C1=CC(=NO1)C)C(=O)C)C(=O)C

Isomeric SMILES

CCOC(=O)C(CCC(=O)C(C1=CC(=NO1)C)C(=O)C)C(=O)C

InChI

InChI=1S/C16H21NO6/c1-5-22-16(21)12(10(3)18)6-7-13(20)15(11(4)19)14-8-9(2)17-23-14/h8,12,15H,5-7H2,1-4H3