3-[[(E)-3-(3-cyanophenyl)prop-2-enoyl]amino]propanoic acid

Systemtic Name: 3-[[(E)-3-(3-cyanophenyl)prop-2-enoyl]amino]propanoic acid Openeye Name: 3-[[(E)-3-(3-cyanophenyl)prop-2-enoyl]amino]propanoic acid CAS Name: 3-[[(E)-3-(3-cyanophenyl)-1-oxoprop-2-enyl]amino]propanoic acid IUPAC Name: 3-[[(E)-3-(3-cyanophenyl)prop-2-enoyl]amino]propanoic acid Traditional Name: 3-[[(E)-3-(3-cyanophenyl)acryloyl]amino]propionic acid Formula: C13H12N2O3 MolecularWeight: 244.24598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C=CC(=O)NCCC(=O)O)C#N

Isomeric SMILES

C1=CC(=CC(=C1)/C=C/C(=O)NCCC(=O)O)C#N

InChI

InChI=1S/C13H12N2O3/c14-9-11-3-1-2-10(8-11)4-5-12(16)15-7-6-13(17)18/h1-5,8H,6-7H2,(H,15,16)(H,17,18)/b5-4+