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

Systemtic Name: 3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-4-carbonitrile Openeye Name: 3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-4-carbonitrile CAS Name: 3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolecarbonitrile IUPAC Name: 3-(3,4-dimethoxyphenyl)-1-phenylpyrazole-4-carbonitrile Traditional Name: 3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-4-carbonitrile Formula: C18H15N3O2 MolecularWeight: 305.3306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C=C2C#N)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C=C2C#N)C3=CC=CC=C3)OC

InChI

InChI=1S/C18H15N3O2/c1-22-16-9-8-13(10-17(16)23-2)18-14(11-19)12-21(20-18)15-6-4-3-5-7-15/h3-10,12H,1-2H3