3-(4-butoxycarbonyl-2,4-dimethyl-hexanoyl)oxyadamantane-1-carboxylic acid

Systemtic Name: 3-(4-butoxycarbonyl-2,4-dimethyl-hexanoyl)oxyadamantane-1-carboxylic acid Openeye Name: 3-(4-butoxycarbonyl-2,4-dimethyl-hexanoyl)oxyadamantane-1-carboxylic acid CAS Name: 3-[4-[butoxy(oxo)methyl]-2,4-dimethyl-1-oxohexoxy]-1-adamantanecarboxylic acid IUPAC Name: 3-(4-butoxycarbonyl-2,4-dimethylhexanoyl)oxyadamantane-1-carboxylic acid Traditional Name: 3-(4-butoxycarbonyl-2,4-dimethyl-hexanoyl)oxyadamantane-1-carboxylic acid Formula: C24H38O6 MolecularWeight: 422.55492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(C)(CC)CC(C)C(=O)OC12CC3CC(C1)CC(C3)(C2)C(=O)O

Isomeric SMILES

CCCCOC(=O)C(C)(CC)CC(C)C(=O)OC12CC3CC(C1)CC(C3)(C2)C(=O)O

InChI

InChI=1S/C24H38O6/c1-5-7-8-29-21(28)22(4,6-2)10-16(3)19(25)30-24-13-17-9-18(14-24)12-23(11-17,15-24)20(26)27/h16-18H,5-15H2,1-4H3,(H,26,27)