2-[(E)-3-(3-methoxyphenyl)prop-2-enoyl]propanedioic acid

Systemtic Name: 2-[(E)-3-(3-methoxyphenyl)prop-2-enoyl]propanedioic acid Openeye Name: 2-[(E)-3-(3-methoxyphenyl)prop-2-enoyl]propanedioic acid CAS Name: 2-[(E)-3-(3-methoxyphenyl)-1-oxoprop-2-enyl]propanedioic acid IUPAC Name: 2-[(E)-3-(3-methoxyphenyl)prop-2-enoyl]propanedioic acid Traditional Name: 2-[(E)-3-(3-methoxyphenyl)acryloyl]malonic acid Formula: C13H12O6 MolecularWeight: 264.23078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C=CC(=O)C(C(=O)O)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)/C=C/C(=O)C(C(=O)O)C(=O)O

InChI

InChI=1S/C13H12O6/c1-19-9-4-2-3-8(7-9)5-6-10(14)11(12(15)16)13(17)18/h2-7,11H,1H3,(H,15,16)(H,17,18)/b6-5+