[(1E,3E)-hexa-1,3,5-trienyl]benzene; 2-methylidenebutanedioic acid

Systemtic Name: [(1E,3E)-hexa-1,3,5-trienyl]benzene; 2-methylidenebutanedioic acid Openeye Name: [(1E,3E)-hexa-1,3,5-trienyl]benzene; 2-methylenebutanedioic acid CAS Name: [(1E,3E)-hexa-1,3,5-trienyl]benzene; 2-methylenebutanedioic acid IUPAC Name: [(1E,3E)-hexa-1,3,5-trienyl]benzene; 2-methylidenebutanedioic acid Traditional Name: [(1E,3E)-hexa-1,3,5-trienyl]benzene; itaconic acid Formula: C17H18O4 MolecularWeight: 286.32242

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Descriptors Computed from Structure

Canonical SMILES:

C=CC=CC=CC1=CC=CC=C1.C=C(CC(=O)O)C(=O)O

Isomeric SMILES

C=C/C=C/C=C/C1=CC=CC=C1.C=C(CC(=O)O)C(=O)O

InChI

InChI=1S/C12H12.C5H6O4/c1-2-3-4-6-9-12-10-7-5-8-11-12;1-3(5(8)9)2-4(6)7/h2-11H,1H2;1-2H2,(H,6,7)(H,8,9)/b4-3+,9-6+;