6-(4-methoxycarbonylphenyl)sulfanyl-7-[(2-methylpropan-2-yl)oxy]-7-oxidanylidene-heptanoic acid

Systemtic Name: 6-(4-methoxycarbonylphenyl)sulfanyl-7-[(2-methylpropan-2-yl)oxy]-7-oxidanylidene-heptanoic acid Openeye Name: 7-tert-butoxy-6-(4-methoxycarbonylphenyl)sulfanyl-7-oxo-heptanoic acid CAS Name: 6-[(4-methoxycarbonylphenyl)thio]-7-[(2-methylpropan-2-yl)oxy]-7-oxoheptanoic acid IUPAC Name: 6-(4-methoxycarbonylphenyl)sulfanyl-7-[(2-methylpropan-2-yl)oxy]-7-oxoheptanoic acid Traditional Name: 7-tert-butoxy-6-[(4-carbomethoxyphenyl)thio]-7-keto-enanthic acid Formula: C19H26O6S MolecularWeight: 382.47114

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCCCC(=O)O)SC1=CC=C(C=C1)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)C(CCCCC(=O)O)SC1=CC=C(C=C1)C(=O)OC

InChI

InChI=1S/C19H26O6S/c1-19(2,3)25-18(23)15(7-5-6-8-16(20)21)26-14-11-9-13(10-12-14)17(22)24-4/h9-12,15H,5-8H2,1-4H3,(H,20,21)