(Z)-3-(5-chloranyl-1,3-diphenyl-pyrazol-4-yl)-2-(3,4-dimethoxyphenyl)prop-2-enenitrile

Systemtic Name: (Z)-3-(5-chloranyl-1,3-diphenyl-pyrazol-4-yl)-2-(3,4-dimethoxyphenyl)prop-2-enenitrile Openeye Name: (Z)-3-(5-chloro-1,3-diphenyl-pyrazol-4-yl)-2-(3,4-dimethoxyphenyl)prop-2-enenitrile CAS Name: (Z)-3-(5-chloro-1,3-diphenyl-4-pyrazolyl)-2-(3,4-dimethoxyphenyl)-2-propenenitrile IUPAC Name: (Z)-3-(5-chloro-1,3-diphenylpyrazol-4-yl)-2-(3,4-dimethoxyphenyl)prop-2-enenitrile Traditional Name: (Z)-3-(5-chloro-1,3-diphenyl-pyrazol-4-yl)-2-(3,4-dimethoxyphenyl)acrylonitrile Formula: C26H20ClN3O2 MolecularWeight: 441.9089

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1=C(C=C(C=C1)/C(=C/C2=C(N(N=C2C3=CC=CC=C3)C4=CC=CC=C4)Cl)/C#N)OC

InChI

InChI=1S/C26H20ClN3O2/c1-31-23-14-13-19(16-24(23)32-2)20(17-28)15-22-25(18-9-5-3-6-10-18)29-30(26(22)27)21-11-7-4-8-12-21/h3-16H,1-2H3/b20-15+