4-(2,2,4-trimethylpentoxycarbonyl)benzene-1,3-dicarboxylic acid

Systemtic Name: 4-(2,2,4-trimethylpentoxycarbonyl)benzene-1,3-dicarboxylic acid Openeye Name: 4-(2,2,4-trimethylpentoxycarbonyl)benzene-1,3-dicarboxylic acid CAS Name: 4-[oxo(2,2,4-trimethylpentoxy)methyl]benzene-1,3-dicarboxylic acid IUPAC Name: 4-(2,2,4-trimethylpentoxycarbonyl)benzene-1,3-dicarboxylic acid Traditional Name: 4-(2,2,4-trimethylpentoxycarbonyl)isophthalic acid Formula: C17H22O6 MolecularWeight: 322.35298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C)(C)COC(=O)C1=C(C=C(C=C1)C(=O)O)C(=O)O

Isomeric SMILES

CC(C)CC(C)(C)COC(=O)C1=C(C=C(C=C1)C(=O)O)C(=O)O

InChI

InChI=1S/C17H22O6/c1-10(2)8-17(3,4)9-23-16(22)12-6-5-11(14(18)19)7-13(12)15(20)21/h5-7,10H,8-9H2,1-4H3,(H,18,19)(H,20,21)