2-[(E)-5-(3,4-dimethylphenyl)pent-2-enoxy]-4-[(2-methylpropan-2-yl)oxy]-3-oxidanyl-4-oxidanylidene-butanoate

Systemtic Name: 2-[(E)-5-(3,4-dimethylphenyl)pent-2-enoxy]-4-[(2-methylpropan-2-yl)oxy]-3-oxidanyl-4-oxidanylidene-butanoate Openeye Name: 4-tert-butoxy-2-[(E)-5-(3,4-dimethylphenyl)pent-2-enoxy]-3-hydroxy-4-oxo-butanoate CAS Name: 2-[(E)-5-(3,4-dimethylphenyl)pent-2-enoxy]-3-hydroxy-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate IUPAC Name: 2-[(E)-5-(3,4-dimethylphenyl)pent-2-enoxy]-3-hydroxy-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate Traditional Name: 4-tert-butoxy-2-[(E)-5-(3,4-dimethylphenyl)pent-2-enoxy]-3-hydroxy-4-keto-butyrate Formula: C21H29O6- MolecularWeight: 377.45136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCC=CCOC(C(C(=O)OC(C)(C)C)O)C(=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)CC/C=C/COC(C(C(=O)OC(C)(C)C)O)C(=O)[O-])C

InChI

InChI=1S/C21H30O6/c1-14-10-11-16(13-15(14)2)9-7-6-8-12-26-18(19(23)24)17(22)20(25)27-21(3,4)5/h6,8,10-11,13,17-18,22H,7,9,12H2,1-5H3,(H,23,24)/p-1/b8-6+