8-(1-adamantyloxycarbonyl)-6-(3-methoxy-2,2-dimethyl-3-oxidanylidene-propyl)-8-methyl-decanoic acid

Systemtic Name: 8-(1-adamantyloxycarbonyl)-6-(3-methoxy-2,2-dimethyl-3-oxidanylidene-propyl)-8-methyl-decanoic acid Openeye Name: 8-(1-adamantyloxycarbonyl)-6-(3-methoxy-2,2-dimethyl-3-oxo-propyl)-8-methyl-decanoic acid CAS Name: 8-[1-adamantyloxy(oxo)methyl]-6-(3-methoxy-2,2-dimethyl-3-oxopropyl)-8-methyldecanoic acid IUPAC Name: 8-(1-adamantyloxycarbonyl)-6-(3-methoxy-2,2-dimethyl-3-oxopropyl)-8-methyldecanoic acid Traditional Name: 8-(1-adamantyloxycarbonyl)-6-(3-keto-3-methoxy-2,2-dimethyl-propyl)-8-methyl-capric acid Formula: C28H46O6 MolecularWeight: 478.66124

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC(CCCCC(=O)O)CC(C)(C)C(=O)OC)C(=O)OC12CC3CC(C1)CC(C3)C2

Isomeric SMILES

CCC(C)(CC(CCCCC(=O)O)CC(C)(C)C(=O)OC)C(=O)OC12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C28H46O6/c1-6-27(4,25(32)34-28-16-20-11-21(17-28)13-22(12-20)18-28)15-19(9-7-8-10-23(29)30)14-26(2,3)24(31)33-5/h19-22H,6-18H2,1-5H3,(H,29,30)