(E)-4-[4-(4-methylimidazol-1-yl)phenyl]but-3-enoic acid

Systemtic Name: (E)-4-[4-(4-methylimidazol-1-yl)phenyl]but-3-enoic acid Openeye Name: (E)-4-[4-(4-methylimidazol-1-yl)phenyl]but-3-enoic acid CAS Name: (E)-4-[4-(4-methyl-1-imidazolyl)phenyl]-3-butenoic acid IUPAC Name: (E)-4-[4-(4-methylimidazol-1-yl)phenyl]but-3-enoic acid Traditional Name: (E)-4-[4-(4-methylimidazol-1-yl)phenyl]but-3-enoic acid Formula: C14H14N2O2 MolecularWeight: 242.27316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C=N1)C2=CC=C(C=C2)C=CCC(=O)O

Isomeric SMILES

CC1=CN(C=N1)C2=CC=C(C=C2)/C=C/CC(=O)O

InChI

InChI=1S/C14H14N2O2/c1-11-9-16(10-15-11)13-7-5-12(6-8-13)3-2-4-14(17)18/h2-3,5-10H,4H2,1H3,(H,17,18)/b3-2+