ethyl (Z)-2-cyano-3-[1-phenyl-3-(3-propoxyphenyl)pyrazol-4-yl]prop-2-enoate

Systemtic Name: ethyl (Z)-2-cyano-3-[1-phenyl-3-(3-propoxyphenyl)pyrazol-4-yl]prop-2-enoate Openeye Name: ethyl (Z)-2-cyano-3-[1-phenyl-3-(3-propoxyphenyl)pyrazol-4-yl]prop-2-enoate CAS Name: (Z)-2-cyano-3-[1-phenyl-3-(3-propoxyphenyl)-4-pyrazolyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (Z)-2-cyano-3-[1-phenyl-3-(3-propoxyphenyl)pyrazol-4-yl]prop-2-enoate Traditional Name: (Z)-2-cyano-3-[1-phenyl-3-(3-propoxyphenyl)pyrazol-4-yl]acrylic acid ethyl ester Formula: C24H23N3O3 MolecularWeight: 401.45772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C2=NN(C=C2C=C(C#N)C(=O)OCC)C3=CC=CC=C3

Isomeric SMILES

CCCOC1=CC=CC(=C1)C2=NN(C=C2/C=C(/C#N)\C(=O)OCC)C3=CC=CC=C3

InChI

InChI=1S/C24H23N3O3/c1-3-13-30-22-12-8-9-18(15-22)23-20(14-19(16-25)24(28)29-4-2)17-27(26-23)21-10-6-5-7-11-21/h5-12,14-15,17H,3-4,13H2,1-2H3/b19-14-