(E)-4-(4-imidazol-1-ylphenyl)but-3-enoic acid

Systemtic Name: (E)-4-(4-imidazol-1-ylphenyl)but-3-enoic acid Openeye Name: (E)-4-(4-imidazol-1-ylphenyl)but-3-enoic acid CAS Name: (E)-4-[4-(1-imidazolyl)phenyl]-3-butenoic acid IUPAC Name: (E)-4-(4-imidazol-1-ylphenyl)but-3-enoic acid Traditional Name: (E)-4-(4-imidazol-1-ylphenyl)but-3-enoic acid Formula: C13H12N2O2 MolecularWeight: 228.24658

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CCC(=O)O)N2C=CN=C2

Isomeric SMILES

C1=CC(=CC=C1/C=C/CC(=O)O)N2C=CN=C2

InChI

InChI=1S/C13H12N2O2/c16-13(17)3-1-2-11-4-6-12(7-5-11)15-9-8-14-10-15/h1-2,4-10H,3H2,(H,16,17)/b2-1+