2-[(E)-but-1-enyl]-2-prop-2-enyl-propanedioic acid

Systemtic Name: 2-[(E)-but-1-enyl]-2-prop-2-enyl-propanedioic acid Openeye Name: 2-allyl-2-[(E)-but-1-enyl]propanedioic acid CAS Name: 2-[(E)-but-1-enyl]-2-prop-2-enylpropanedioic acid IUPAC Name: 2-[(E)-but-1-enyl]-2-prop-2-enylpropanedioic acid Traditional Name: 2-allyl-2-[(E)-but-1-enyl]malonic acid Formula: C10H14O4 MolecularWeight: 198.21576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC=CC(CC=C)(C(=O)O)C(=O)O

Isomeric SMILES

CC/C=C/C(CC=C)(C(=O)O)C(=O)O

InChI

InChI=1S/C10H14O4/c1-3-5-7-10(6-4-2,8(11)12)9(13)14/h4-5,7H,2-3,6H2,1H3,(H,11,12)(H,13,14)/b7-5+