ethyl 2-[5-(cyanomethoxy)-3-methyl-1-phenyl-pyrazol-4-yl]-3,3-diphenyl-prop-2-enoate

Systemtic Name: ethyl 2-[5-(cyanomethoxy)-3-methyl-1-phenyl-pyrazol-4-yl]-3,3-diphenyl-prop-2-enoate Openeye Name: ethyl 2-[5-(cyanomethoxy)-3-methyl-1-phenyl-pyrazol-4-yl]-3,3-diphenyl-prop-2-enoate CAS Name: 2-[5-(cyanomethoxy)-3-methyl-1-phenyl-4-pyrazolyl]-3,3-diphenyl-2-propenoic acid ethyl ester IUPAC Name: ethyl 2-[5-(cyanomethoxy)-3-methyl-1-phenylpyrazol-4-yl]-3,3-diphenylprop-2-enoate Traditional Name: 2-[5-(cyanomethoxy)-3-methyl-1-phenyl-pyrazol-4-yl]-3,3-diphenyl-acrylic acid ethyl ester Formula: C29H25N3O3 MolecularWeight: 463.5271

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C1=CC=CC=C1)C2=CC=CC=C2)C3=C(N(N=C3C)C4=CC=CC=C4)OCC#N

Isomeric SMILES

CCOC(=O)C(=C(C1=CC=CC=C1)C2=CC=CC=C2)C3=C(N(N=C3C)C4=CC=CC=C4)OCC#N

InChI

InChI=1S/C29H25N3O3/c1-3-34-29(33)27(26(22-13-7-4-8-14-22)23-15-9-5-10-16-23)25-21(2)31-32(28(25)35-20-19-30)24-17-11-6-12-18-24/h4-18H,3,20H2,1-2H3