dimethyl benzene-1,3-dicarboxylate; 2,2,4-trimethylpentane-1,3-diol

Systemtic Name: dimethyl benzene-1,3-dicarboxylate; 2,2,4-trimethylpentane-1,3-diol Openeye Name: dimethyl benzene-1,3-dicarboxylate; 2,2,4-trimethylpentane-1,3-diol CAS Name: benzene-1,3-dicarboxylic acid dimethyl ester; 2,2,4-trimethylpentane-1,3-diol IUPAC Name: dimethyl benzene-1,3-dicarboxylate; 2,2,4-trimethylpentane-1,3-diol Traditional Name: benzene-1,3-dicarboxylic acid dimethyl ester; 2,2,4-trimethylpentane-1,3-diol Formula: C18H28O6 MolecularWeight: 340.41132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C)(C)CO)O.COC(=O)C1=CC(=CC=C1)C(=O)OC

Isomeric SMILES

CC(C)C(C(C)(C)CO)O.COC(=O)C1=CC(=CC=C1)C(=O)OC

InChI

InChI=1S/C10H10O4.C8H18O2/c1-13-9(11)7-4-3-5-8(6-7)10(12)14-2;1-6(2)7(10)8(3,4)5-9/h3-6H,1-2H3;6-7,9-10H,5H2,1-4H3