hexyl (Z)-4-hexoxy-3,4-bis(oxidanyl)-2-oxidanylidene-but-3-enoate

Systemtic Name: hexyl (Z)-4-hexoxy-3,4-bis(oxidanyl)-2-oxidanylidene-but-3-enoate Openeye Name: hexyl (Z)-4-hexoxy-3,4-dihydroxy-2-oxo-but-3-enoate CAS Name: (Z)-4-hexoxy-3,4-dihydroxy-2-oxo-3-butenoic acid hexyl ester IUPAC Name: hexyl (Z)-4-hexoxy-3,4-dihydroxy-2-oxobut-3-enoate Traditional Name: (Z)-4-hexoxy-3,4-dihydroxy-2-keto-but-3-enoic acid hexyl ester Formula: C16H28O6 MolecularWeight: 316.38992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=C(C(=O)C(=O)OCCCCCC)O)O

Isomeric SMILES

CCCCCCO/C(=C(/C(=O)C(=O)OCCCCCC)\O)/O

InChI

InChI=1S/C16H28O6/c1-3-5-7-9-11-21-15(19)13(17)14(18)16(20)22-12-10-8-6-4-2/h17,19H,3-12H2,1-2H3/b15-13-