5-ethyl-4-methyl-benzene-1,3-dicarboxylic acid

Systemtic Name: 5-ethyl-4-methyl-benzene-1,3-dicarboxylic acid Openeye Name: 5-ethyl-4-methyl-benzene-1,3-dicarboxylic acid CAS Name: 5-ethyl-4-methylbenzene-1,3-dicarboxylic acid IUPAC Name: 5-ethyl-4-methylbenzene-1,3-dicarboxylic acid Traditional Name: 5-ethyl-4-methyl-isophthalic acid Formula: C11H12O4 MolecularWeight: 208.21058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1C)C(=O)O)C(=O)O

Isomeric SMILES

CCC1=CC(=CC(=C1C)C(=O)O)C(=O)O

InChI

InChI=1S/C11H12O4/c1-3-7-4-8(10(12)13)5-9(6(7)2)11(14)15/h4-5H,3H2,1-2H3,(H,12,13)(H,14,15)