2-methylidenebutanedioic acid; (2E)-1-methyl-2-propylidene-cyclopropane

Systemtic Name: 2-methylidenebutanedioic acid; (2E)-1-methyl-2-propylidene-cyclopropane Openeye Name: 2-methylenebutanedioic acid; (2E)-1-methyl-2-propylidene-cyclopropane CAS Name: 2-methylenebutanedioic acid; (2E)-1-methyl-2-propylidenecyclopropane IUPAC Name: 2-methylidenebutanedioic acid; (2E)-1-methyl-2-propylidenecyclopropane Traditional Name: itaconic acid; (2E)-1-methyl-2-propylidene-cyclopropane Formula: C12H18O4 MolecularWeight: 226.26892

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Descriptors Computed from Structure

Canonical SMILES:

CCC=C1CC1C.C=C(CC(=O)O)C(=O)O

Isomeric SMILES

CC/C=C/1\CC1C.C=C(CC(=O)O)C(=O)O

InChI

InChI=1S/C7H12.C5H6O4/c1-3-4-7-5-6(7)2;1-3(5(8)9)2-4(6)7/h4,6H,3,5H2,1-2H3;1-2H2,(H,6,7)(H,8,9)/b7-4+;