5-(3,4-dimethoxyphenyl)-1H-pyrazole-4-carbonitrile

Systemtic Name: 5-(3,4-dimethoxyphenyl)-1H-pyrazole-4-carbonitrile Openeye Name: 5-(3,4-dimethoxyphenyl)-1H-pyrazole-4-carbonitrile CAS Name: 5-(3,4-dimethoxyphenyl)-1H-pyrazole-4-carbonitrile IUPAC Name: 5-(3,4-dimethoxyphenyl)-1H-pyrazole-4-carbonitrile Traditional Name: 5-(3,4-dimethoxyphenyl)-1H-pyrazole-4-carbonitrile Formula: C12H11N3O2 MolecularWeight: 229.23464

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C=NN2)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C=NN2)C#N)OC

InChI

InChI=1S/C12H11N3O2/c1-16-10-4-3-8(5-11(10)17-2)12-9(6-13)7-14-15-12/h3-5,7H,1-2H3,(H,14,15)