O4-(1-adamantyl) O1,O2-ditert-butyl 2,4-dimethylhexane-1,2,4-tricarboxylate

Systemtic Name: O4-(1-adamantyl) O1,O2-ditert-butyl 2,4-dimethylhexane-1,2,4-tricarboxylate Openeye Name: O4-(1-adamantyl) O1,O2-ditert-butyl 2,4-dimethylhexane-1,2,4-tricarboxylate CAS Name: 2,4-dimethylhexane-1,2,4-tricarboxylic acid O4-(1-adamantyl) ester O1,O2-ditert-butyl ester IUPAC Name: 4-O-(1-adamantyl) 1-O,2-O-ditert-butyl 2,4-dimethylhexane-1,2,4-tricarboxylate Traditional Name: 2,4-dimethylhexane-1,2,4-tricarboxylic acid O4-(1-adamantyl) ester O1,O2-ditert-butyl ester Formula: C29H48O6 MolecularWeight: 492.68782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H48O6/c1-10-27(8,23(31)35-29-14-19-11-20(15-29)13-21(12-19)16-29)18-28(9,24(32)34-26(5,6)7)17-22(30)33-25(2,3)4/h19-21H,10-18H2,1-9H3