(E)-2-(3-methoxyphenyl)carbonyl-3-(1-phenyl-3-pyridin-4-yl-pyrazol-4-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(3-methoxyphenyl)carbonyl-3-(1-phenyl-3-pyridin-4-yl-pyrazol-4-yl)prop-2-enenitrile Openeye Name: (E)-2-(3-methoxybenzoyl)-3-[1-phenyl-3-(4-pyridyl)pyrazol-4-yl]prop-2-enenitrile CAS Name: (E)-2-[(3-methoxyphenyl)-oxomethyl]-3-(1-phenyl-3-pyridin-4-yl-4-pyrazolyl)-2-propenenitrile IUPAC Name: (E)-2-(3-methoxybenzoyl)-3-(1-phenyl-3-pyridin-4-ylpyrazol-4-yl)prop-2-enenitrile Traditional Name: (E)-2-m-anisoyl-3-[1-phenyl-3-(4-pyridyl)pyrazol-4-yl]acrylonitrile Formula: C25H18N4O2 MolecularWeight: 406.43602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)/C(=C/C2=CN(N=C2C3=CC=NC=C3)C4=CC=CC=C4)/C#N

InChI

InChI=1S/C25H18N4O2/c1-31-23-9-5-6-19(15-23)25(30)20(16-26)14-21-17-29(22-7-3-2-4-8-22)28-24(21)18-10-12-27-13-11-18/h2-15,17H,1H3/b20-14+