2,3-dimethoxy-5-(5-phenyl-1H-pyrazol-4-yl)benzenecarbonitrile

Systemtic Name: 2,3-dimethoxy-5-(5-phenyl-1H-pyrazol-4-yl)benzenecarbonitrile Openeye Name: 2,3-dimethoxy-5-(5-phenyl-1H-pyrazol-4-yl)benzonitrile CAS Name: 2,3-dimethoxy-5-(5-phenyl-1H-pyrazol-4-yl)benzonitrile IUPAC Name: 2,3-dimethoxy-5-(5-phenyl-1H-pyrazol-4-yl)benzonitrile Traditional Name: 2,3-dimethoxy-5-(5-phenyl-1H-pyrazol-4-yl)benzonitrile Formula: C18H15N3O2 MolecularWeight: 305.3306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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