2,2,4-trimethyl-4-(oxan-2-yloxycarbonyl)-6-[2-(4-oxidanylidene-1-adamantyl)propan-2-yloxycarbonyl]octanoic acid

Systemtic Name: 2,2,4-trimethyl-4-(oxan-2-yloxycarbonyl)-6-[2-(4-oxidanylidene-1-adamantyl)propan-2-yloxycarbonyl]octanoic acid Openeye Name: 2,2,4-trimethyl-6-[1-methyl-1-(4-oxo-1-adamantyl)ethoxy]carbonyl-4-tetrahydropyran-2-yloxycarbonyl-octanoic acid CAS Name: 2,2,4-trimethyl-4-[2-oxanyloxy(oxo)methyl]-6-[oxo-[2-(4-oxo-1-adamantyl)propan-2-yloxy]methyl]octanoic acid IUPAC Name: 2,2,4-trimethyl-4-(oxan-2-yloxycarbonyl)-6-[2-(4-oxo-1-adamantyl)propan-2-yloxycarbonyl]octanoic acid Traditional Name: 6-[1-(4-keto-1-adamantyl)-1-methyl-ethoxy]carbonyl-2,2,4-trimethyl-4-tetrahydropyran-2-yloxycarbonyl-caprylic acid Formula: C31H48O8 MolecularWeight: 548.70802

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C)(CC(C)(C)C(=O)O)C(=O)OC1CCCCO1)C(=O)OC(C)(C)C23CC4CC(C2)C(=O)C(C4)C3

Isomeric SMILES

CCC(CC(C)(CC(C)(C)C(=O)O)C(=O)OC1CCCCO1)C(=O)OC(C)(C)C23CC4CC(C2)C(=O)C(C4)C3

InChI

InChI=1S/C31H48O8/c1-7-20(15-30(6,18-28(2,3)26(34)35)27(36)38-23-10-8-9-11-37-23)25(33)39-29(4,5)31-14-19-12-21(16-31)24(32)22(13-19)17-31/h19-23H,7-18H2,1-6H3,(H,34,35)