(2S)-3-(3-ethylimidazol-4-yl)-2-[[(E)-3-phenylprop-2-enoyl]amino]propanoic acid

Systemtic Name: (2S)-3-(3-ethylimidazol-4-yl)-2-[[(E)-3-phenylprop-2-enoyl]amino]propanoic acid Openeye Name: (2S)-3-(3-ethylimidazol-4-yl)-2-[[(E)-3-phenylprop-2-enoyl]amino]propanoic acid CAS Name: (2S)-3-(3-ethyl-4-imidazolyl)-2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]propanoic acid IUPAC Name: (2S)-3-(3-ethylimidazol-4-yl)-2-[[(E)-3-phenylprop-2-enoyl]amino]propanoic acid Traditional Name: (2S)-3-(3-ethylimidazol-4-yl)-2-[[(E)-3-phenylacryloyl]amino]propionic acid Formula: C17H19N3O3 MolecularWeight: 313.35106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC=C1CC(C(=O)O)NC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CCN1C=NC=C1C[C@@H](C(=O)O)NC(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C17H19N3O3/c1-2-20-12-18-11-14(20)10-15(17(22)23)19-16(21)9-8-13-6-4-3-5-7-13/h3-9,11-12,15H,2,10H2,1H3,(H,19,21)(H,22,23)/b9-8+/t15-/m0/s1