(E)-5-acetamido-2-(ethynylamino)pent-3-enoic acid

Systemtic Name: (E)-5-acetamido-2-(ethynylamino)pent-3-enoic acid Openeye Name: (E)-5-acetamido-2-(ethynylamino)pent-3-enoic acid CAS Name: (E)-5-acetamido-2-(ethynylamino)-3-pentenoic acid IUPAC Name: (E)-5-acetamido-2-(ethynylamino)pent-3-enoic acid Traditional Name: (E)-5-acetamido-2-(ethynylamino)pent-3-enoic acid Formula: C9H12N2O3 MolecularWeight: 196.20318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC=CC(C(=O)O)NC#C

Isomeric SMILES

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

InChI

InChI=1S/C9H12N2O3/c1-3-10-8(9(13)14)5-4-6-11-7(2)12/h1,4-5,8,10H,6H2,2H3,(H,11,12)(H,13,14)/b5-4+