ethyl (E)-3-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-2-cyano-acrylic acid ethyl ester Formula: C15H12ClN3O2 MolecularWeight: 301.72768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=C(NN=C1)C2=CC=C(C=C2)Cl)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=C(NN=C1)C2=CC=C(C=C2)Cl)/C#N

InChI

InChI=1S/C15H12ClN3O2/c1-2-21-15(20)11(8-17)7-12-9-18-19-14(12)10-3-5-13(16)6-4-10/h3-7,9H,2H2,1H3,(H,18,19)/b11-7+