2,2,4,6-tetramethyl-6-[(2-methyl-2-adamantyl)oxycarbonyl]-4-(3-oxidanylidenecyclohexyl)oxycarbonyl-octanoic acid

Systemtic Name: 2,2,4,6-tetramethyl-6-[(2-methyl-2-adamantyl)oxycarbonyl]-4-(3-oxidanylidenecyclohexyl)oxycarbonyl-octanoic acid Openeye Name: 2,2,4,6-tetramethyl-6-[(2-methyl-2-adamantyl)oxycarbonyl]-4-(3-oxocyclohexoxy)carbonyl-octanoic acid CAS Name: 2,2,4,6-tetramethyl-6-[(2-methyl-2-adamantyl)oxy-oxomethyl]-4-[oxo-(3-oxocyclohexyl)oxymethyl]octanoic acid IUPAC Name: 2,2,4,6-tetramethyl-6-[(2-methyl-2-adamantyl)oxycarbonyl]-4-(3-oxocyclohexyl)oxycarbonyloctanoic acid Traditional Name: 4-(3-ketocyclohexoxy)carbonyl-2,2,4,6-tetramethyl-6-[(2-methyl-2-adamantyl)oxycarbonyl]caprylic acid Formula: C31H48O7 MolecularWeight: 532.70862

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC(C)(CC(C)(C)C(=O)O)C(=O)OC1CCCC(=O)C1)C(=O)OC2(C3CC4CC(C3)CC2C4)C

Isomeric SMILES

CCC(C)(CC(C)(CC(C)(C)C(=O)O)C(=O)OC1CCCC(=O)C1)C(=O)OC2(C3CC4CC(C3)CC2C4)C

InChI

InChI=1S/C31H48O7/c1-7-29(4,27(36)38-31(6)21-12-19-11-20(14-21)15-22(31)13-19)18-30(5,17-28(2,3)25(33)34)26(35)37-24-10-8-9-23(32)16-24/h19-22,24H,7-18H2,1-6H3,(H,33,34)