O3-(1-adamantyl) O1,O2-ditert-butyl 1,3-dimethylpentane-1,2,3-tricarboxylate

Systemtic Name: O3-(1-adamantyl) O1,O2-ditert-butyl 1,3-dimethylpentane-1,2,3-tricarboxylate Openeye Name: O3-(1-adamantyl) O1,O2-ditert-butyl 1,3-dimethylpentane-1,2,3-tricarboxylate CAS Name: 1,3-dimethylpentane-1,2,3-tricarboxylic acid O3-(1-adamantyl) ester O1,O2-ditert-butyl ester IUPAC Name: 3-O-(1-adamantyl) 1-O,2-O-ditert-butyl 1,3-dimethylpentane-1,2,3-tricarboxylate Traditional Name: 1,3-dimethylpentane-1,2,3-tricarboxylic acid O3-(1-adamantyl) ester O1,O2-ditert-butyl ester Formula: C28H46O6 MolecularWeight: 478.66124

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H46O6/c1-10-27(9,24(31)34-28-14-18-11-19(15-28)13-20(12-18)16-28)21(23(30)33-26(6,7)8)17(2)22(29)32-25(3,4)5/h17-21H,10-16H2,1-9H3