(E)-4-(2-phenylethanoylamino)but-2-enoic acid

Systemtic Name: (E)-4-(2-phenylethanoylamino)but-2-enoic acid Openeye Name: (E)-4-[(2-phenylacetyl)amino]but-2-enoic acid CAS Name: (E)-4-[(1-oxo-2-phenylethyl)amino]-2-butenoic acid IUPAC Name: (E)-4-[(2-phenylacetyl)amino]but-2-enoic acid Traditional Name: (E)-4-[(2-phenylacetyl)amino]but-2-enoic acid Formula: C12H13NO3 MolecularWeight: 219.23652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NCC=CC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO3/c14-11(13-8-4-7-12(15)16)9-10-5-2-1-3-6-10/h1-7H,8-9H2,(H,13,14)(H,15,16)/b7-4+