(E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-(4-methoxyphenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-(4-methoxyphenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-(4-methoxybenzoyl)prop-2-enenitrile CAS Name: (E)-3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-[(4-methoxyphenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-(4-methoxybenzoyl)prop-2-enenitrile Traditional Name: (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-p-anisoyl-acrylonitrile Formula: C22H19N3O2 MolecularWeight: 357.40516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C=C(C#N)C(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)/C=C(\C#N)/C(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H19N3O2/c1-15-21(16(2)25(24-15)19-7-5-4-6-8-19)13-18(14-23)22(26)17-9-11-20(27-3)12-10-17/h4-13H,1-3H3/b18-13+