2-(3,4-dimethoxyphenyl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enenitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enenitrile CAS Name: 2-(3,4-dimethoxyphenyl)-3-(1,3-diphenyl-4-pyrazolyl)-2-propenenitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enenitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-3-(1,3-diphenylpyrazol-4-yl)acrylonitrile Formula: C26H21N3O2 MolecularWeight: 407.46384

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C#N)OC

InChI

InChI=1S/C26H21N3O2/c1-30-24-14-13-20(16-25(24)31-2)21(17-27)15-22-18-29(23-11-7-4-8-12-23)28-26(22)19-9-5-3-6-10-19/h3-16,18H,1-2H3