[(E)-3-phenylprop-2-enyl] 4-(pyrazol-1-ylmethyl)benzoate

Systemtic Name: [(E)-3-phenylprop-2-enyl] 4-(pyrazol-1-ylmethyl)benzoate Openeye Name: [(E)-cinnamyl] 4-(pyrazol-1-ylmethyl)benzoate CAS Name: 4-(1-pyrazolylmethyl)benzoic acid [(E)-3-phenylprop-2-enyl] ester IUPAC Name: [(E)-3-phenylprop-2-enyl] 4-(pyrazol-1-ylmethyl)benzoate Traditional Name: 4-(pyrazol-1-ylmethyl)benzoic acid [(E)-cinnamyl] ester Formula: C20H18N2O2 MolecularWeight: 318.36912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCOC(=O)C2=CC=C(C=C2)CN3C=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)/C=C/COC(=O)C2=CC=C(C=C2)CN3C=CC=N3

InChI

InChI=1S/C20H18N2O2/c23-20(24-15-4-8-17-6-2-1-3-7-17)19-11-9-18(10-12-19)16-22-14-5-13-21-22/h1-14H,15-16H2/b8-4+