4-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]butanoic acid

Systemtic Name: 4-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]butanoic acid Openeye Name: 4-[[(E)-3-(3-pyridyl)prop-2-enoyl]amino]butanoic acid CAS Name: 4-[[(E)-1-oxo-3-(3-pyridinyl)prop-2-enyl]amino]butanoic acid IUPAC Name: 4-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]butanoic acid Traditional Name: 4-[[(E)-3-(3-pyridyl)acryloyl]amino]butyric acid Formula: C12H14N2O3 MolecularWeight: 234.25116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C=CC(=O)NCCCC(=O)O

Isomeric SMILES

C1=CC(=CN=C1)/C=C/C(=O)NCCCC(=O)O

InChI

InChI=1S/C12H14N2O3/c15-11(14-8-2-4-12(16)17)6-5-10-3-1-7-13-9-10/h1,3,5-7,9H,2,4,8H2,(H,14,15)(H,16,17)/b6-5+