4-prop-1-en-2-yloxycarbonylbenzene-1,2,3-tricarboxylic acid

Systemtic Name: 4-prop-1-en-2-yloxycarbonylbenzene-1,2,3-tricarboxylic acid Openeye Name: 4-isopropenyloxycarbonylbenzene-1,2,3-tricarboxylic acid CAS Name: 4-[1-methylethenoxy(oxo)methyl]benzene-1,2,3-tricarboxylic acid IUPAC Name: 4-prop-1-en-2-yloxycarbonylbenzene-1,2,3-tricarboxylic acid Traditional Name: 4-isopropenyloxycarbonylhemimellitic acid Formula: C13H10O8 MolecularWeight: 294.2137

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10O8/c1-5(2)21-13(20)7-4-3-6(10(14)15)8(11(16)17)9(7)12(18)19/h3-4H,1H2,2H3,(H,14,15)(H,16,17)(H,18,19)