3-(3,4-dimethylphenyl)-1-phenyl-pyrazole-4-carbonitrile

Systemtic Name: 3-(3,4-dimethylphenyl)-1-phenyl-pyrazole-4-carbonitrile Openeye Name: 3-(3,4-dimethylphenyl)-1-phenyl-pyrazole-4-carbonitrile CAS Name: 3-(3,4-dimethylphenyl)-1-phenyl-4-pyrazolecarbonitrile IUPAC Name: 3-(3,4-dimethylphenyl)-1-phenylpyrazole-4-carbonitrile Traditional Name: 3-(3,4-dimethylphenyl)-1-phenyl-pyrazole-4-carbonitrile Formula: C18H15N3 MolecularWeight: 273.3318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C=C2C#N)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C=C2C#N)C3=CC=CC=C3)C

InChI

InChI=1S/C18H15N3/c1-13-8-9-15(10-14(13)2)18-16(11-19)12-21(20-18)17-6-4-3-5-7-17/h3-10,12H,1-2H3