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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=CC=C(C=C2)C=CCC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C13H12N2O2/c16-13(17)4-1-3-11-5-7-12(8-6-11)15-10-2-9-14-15/h1-3,5-10H,4H2,(H,16,17)/b3-1+