5-iodanyl-2,4-dimethyl-benzene-1,3-dicarboxylate

Systemtic Name: 5-iodanyl-2,4-dimethyl-benzene-1,3-dicarboxylate Openeye Name: 5-iodo-2,4-dimethyl-benzene-1,3-dicarboxylate CAS Name: 5-iodo-2,4-dimethylbenzene-1,3-dicarboxylate IUPAC Name: 5-iodo-2,4-dimethylbenzene-1,3-dicarboxylate Traditional Name: 5-iodo-2,4-dimethyl-isophthalate Formula: C10H7IO4-2 MolecularWeight: 318.06465

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1C(=O)[O-])I)C)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=C(C=C1C(=O)[O-])I)C)C(=O)[O-]

InChI

InChI=1S/C10H9IO4/c1-4-6(9(12)13)3-7(11)5(2)8(4)10(14)15/h3H,1-2H3,(H,12,13)(H,14,15)/p-2