2-(3-ethynylphenoxy)-4-(imidazol-1-ylmethyl)benzenecarbonitrile

Systemtic Name: 2-(3-ethynylphenoxy)-4-(imidazol-1-ylmethyl)benzenecarbonitrile Openeye Name: 2-(3-ethynylphenoxy)-4-(imidazol-1-ylmethyl)benzonitrile CAS Name: 2-(3-ethynylphenoxy)-4-(1-imidazolylmethyl)benzonitrile IUPAC Name: 2-(3-ethynylphenoxy)-4-(imidazol-1-ylmethyl)benzonitrile Traditional Name: 2-(3-ethynylphenoxy)-4-(imidazol-1-ylmethyl)benzonitrile Formula: C19H13N3O MolecularWeight: 299.32602

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)OC2=C(C=CC(=C2)CN3C=CN=C3)C#N

Isomeric SMILES

C#CC1=CC(=CC=C1)OC2=C(C=CC(=C2)CN3C=CN=C3)C#N

InChI

InChI=1S/C19H13N3O/c1-2-15-4-3-5-18(10-15)23-19-11-16(6-7-17(19)12-20)13-22-9-8-21-14-22/h1,3-11,14H,13H2