O2,O2-ditert-butyl O1-(phenylmethyl) 1,4-dimethylpentane-1,2,2-tricarboxylate

Systemtic Name: O2,O2-ditert-butyl O1-(phenylmethyl) 1,4-dimethylpentane-1,2,2-tricarboxylate Openeye Name: O1-benzyl O2,O2-ditert-butyl 1,4-dimethylpentane-1,2,2-tricarboxylate CAS Name: 1,4-dimethylpentane-1,2,2-tricarboxylic acid O2,O2-ditert-butyl ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 2-O,2-O-ditert-butyl 1,4-dimethylpentane-1,2,2-tricarboxylate Traditional Name: 1,4-dimethylpentane-1,2,2-tricarboxylic acid O1-benzyl ester O2,O2-ditert-butyl ester Formula: C25H38O6 MolecularWeight: 434.56562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(C)C(=O)OCC1=CC=CC=C1)(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)CC(C(C)C(=O)OCC1=CC=CC=C1)(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C25H38O6/c1-17(2)15-25(21(27)30-23(4,5)6,22(28)31-24(7,8)9)18(3)20(26)29-16-19-13-11-10-12-14-19/h10-14,17-18H,15-16H2,1-9H3