(Z)-3-[3-(4-cyclohexylphenyl)-1-phenyl-pyrazol-4-yl]-2-(3,4-dimethoxyphenyl)prop-2-enenitrile

Systemtic Name: (Z)-3-[3-(4-cyclohexylphenyl)-1-phenyl-pyrazol-4-yl]-2-(3,4-dimethoxyphenyl)prop-2-enenitrile Openeye Name: (Z)-3-[3-(4-cyclohexylphenyl)-1-phenyl-pyrazol-4-yl]-2-(3,4-dimethoxyphenyl)prop-2-enenitrile CAS Name: (Z)-3-[3-(4-cyclohexylphenyl)-1-phenyl-4-pyrazolyl]-2-(3,4-dimethoxyphenyl)-2-propenenitrile IUPAC Name: (Z)-3-[3-(4-cyclohexylphenyl)-1-phenylpyrazol-4-yl]-2-(3,4-dimethoxyphenyl)prop-2-enenitrile Traditional Name: (Z)-3-[3-(4-cyclohexylphenyl)-1-phenyl-pyrazol-4-yl]-2-(3,4-dimethoxyphenyl)acrylonitrile Formula: C32H31N3O2 MolecularWeight: 489.60744

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=CC2=CN(N=C2C3=CC=C(C=C3)C4CCCCC4)C5=CC=CC=C5)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C(=C/C2=CN(N=C2C3=CC=C(C=C3)C4CCCCC4)C5=CC=CC=C5)/C#N)OC

InChI

InChI=1S/C32H31N3O2/c1-36-30-18-17-26(20-31(30)37-2)27(21-33)19-28-22-35(29-11-7-4-8-12-29)34-32(28)25-15-13-24(14-16-25)23-9-5-3-6-10-23/h4,7-8,11-20,22-23H,3,5-6,9-10H2,1-2H3/b27-19+