2-methylidenebutanedioic acid; (Z)-2-methyl-4-methylidene-pent-2-enedioate

Systemtic Name: 2-methylidenebutanedioic acid; (Z)-2-methyl-4-methylidene-pent-2-enedioate Openeye Name: 2-methylenebutanedioic acid; (Z)-2-methyl-4-methylene-pent-2-enedioate CAS Name: 2-methylenebutanedioic acid; (Z)-2-methyl-4-methylene-2-pentenedioate IUPAC Name: 2-methylidenebutanedioic acid; (Z)-2-methyl-4-methylidenepent-2-enedioate Traditional Name: itaconic acid; (Z)-2-methyl-4-methylene-pent-2-enedioate Formula: C12H12O8-2 MolecularWeight: 284.21888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=C)C(=O)[O-])C(=O)[O-].C=C(CC(=O)O)C(=O)O

Isomeric SMILES

C/C(=C/C(=C)C(=O)[O-])/C(=O)[O-].C=C(CC(=O)O)C(=O)O

InChI

InChI=1S/C7H8O4.C5H6O4/c1-4(6(8)9)3-5(2)7(10)11;1-3(5(8)9)2-4(6)7/h3H,1H2,2H3,(H,8,9)(H,10,11);1-2H2,(H,6,7)(H,8,9)/p-2/b5-3-;