2-(4-pyrazol-1-ylphenyl)but-3-enoic acid

Systemtic Name: 2-(4-pyrazol-1-ylphenyl)but-3-enoic acid Openeye Name: 2-(4-pyrazol-1-ylphenyl)but-3-enoic acid CAS Name: 2-[4-(1-pyrazolyl)phenyl]-3-butenoic acid IUPAC Name: 2-(4-pyrazol-1-ylphenyl)but-3-enoic acid Traditional Name: 2-(4-pyrazol-1-ylphenyl)but-3-enoic acid Formula: C13H12N2O2 MolecularWeight: 228.24658

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(C1=CC=C(C=C1)N2C=CC=N2)C(=O)O

Isomeric SMILES

C=CC(C1=CC=C(C=C1)N2C=CC=N2)C(=O)O

InChI

InChI=1S/C13H12N2O2/c1-2-12(13(16)17)10-4-6-11(7-5-10)15-9-3-8-14-15/h2-9,12H,1H2,(H,16,17)