1-(3-methoxyphenyl)-3,5-dimethyl-pyrazole-4-carbonitrile

Systemtic Name: 1-(3-methoxyphenyl)-3,5-dimethyl-pyrazole-4-carbonitrile Openeye Name: 1-(3-methoxyphenyl)-3,5-dimethyl-pyrazole-4-carbonitrile CAS Name: 1-(3-methoxyphenyl)-3,5-dimethyl-4-pyrazolecarbonitrile IUPAC Name: 1-(3-methoxyphenyl)-3,5-dimethylpyrazole-4-carbonitrile Traditional Name: 1-(3-methoxyphenyl)-3,5-dimethyl-pyrazole-4-carbonitrile Formula: C13H13N3O MolecularWeight: 227.26182

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13N3O/c1-9-13(8-14)10(2)16(15-9)11-5-4-6-12(7-11)17-3/h4-7H,1-3H3