2-(3,4-dimethoxyphenyl)-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanenitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-2-(5-phenyl-3,4-dihydropyrazol-2-yl)acetonitrile CAS Name: 2-(3,4-dimethoxyphenyl)-2-(5-phenyl-3,4-dihydropyrazol-2-yl)acetonitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-2-(5-phenyl-3,4-dihydropyrazol-2-yl)acetonitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-2-(3-phenyl-2-pyrazolin-1-yl)acetonitrile Formula: C19H19N3O2 MolecularWeight: 321.37306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C#N)N2CCC(=N2)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C#N)N2CCC(=N2)C3=CC=CC=C3)OC

InChI

InChI=1S/C19H19N3O2/c1-23-18-9-8-15(12-19(18)24-2)17(13-20)22-11-10-16(21-22)14-6-4-3-5-7-14/h3-9,12,17H,10-11H2,1-2H3