methyl 5-methyl-2-oxidanyl-4-oxidanylidene-hex-2-enoate

Systemtic Name: methyl 5-methyl-2-oxidanyl-4-oxidanylidene-hex-2-enoate Openeye Name: methyl 2-hydroxy-5-methyl-4-oxo-hex-2-enoate CAS Name: 2-hydroxy-5-methyl-4-oxo-2-hexenoic acid methyl ester IUPAC Name: methyl 2-hydroxy-5-methyl-4-oxohex-2-enoate Traditional Name: 2-hydroxy-4-keto-5-methyl-hex-2-enoic acid methyl ester Formula: C8H12O4 MolecularWeight: 172.17848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C=C(C(=O)OC)O

Isomeric SMILES

CC(C)C(=O)C=C(C(=O)OC)O

InChI

InChI=1S/C8H12O4/c1-5(2)6(9)4-7(10)8(11)12-3/h4-5,10H,1-3H3