(2S)-2-[(E)-3-phenylprop-2-enyl]butanedioic acid

Systemtic Name: (2S)-2-[(E)-3-phenylprop-2-enyl]butanedioic acid Openeye Name: (2S)-2-[(E)-cinnamyl]butanedioic acid CAS Name: (2S)-2-[(E)-3-phenylprop-2-enyl]butanedioic acid IUPAC Name: (2S)-2-[(E)-3-phenylprop-2-enyl]butanedioic acid Traditional Name: (2S)-2-[(E)-cinnamyl]succinic acid Formula: C13H14O4 MolecularWeight: 234.24786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCC(CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C[C@@H](CC(=O)O)C(=O)O

InChI

InChI=1S/C13H14O4/c14-12(15)9-11(13(16)17)8-4-7-10-5-2-1-3-6-10/h1-7,11H,8-9H2,(H,14,15)(H,16,17)/b7-4+/t11-/m0/s1