3-[4-(3-cyanophenyl)-1,2,3-triazol-1-yl]-4-oxidanyl-benzenecarbonitrile

Systemtic Name: 3-[4-(3-cyanophenyl)-1,2,3-triazol-1-yl]-4-oxidanyl-benzenecarbonitrile Openeye Name: 3-[4-(3-cyanophenyl)triazol-1-yl]-4-hydroxy-benzonitrile CAS Name: 3-[4-(3-cyanophenyl)-1-triazolyl]-4-hydroxybenzonitrile IUPAC Name: 3-[4-(3-cyanophenyl)triazol-1-yl]-4-hydroxybenzonitrile Traditional Name: 3-[4-(3-cyanophenyl)triazol-1-yl]-4-hydroxy-benzonitrile Formula: C16H9N5O MolecularWeight: 287.27556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C2=CN(N=N2)C3=C(C=CC(=C3)C#N)O)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C2=CN(N=N2)C3=C(C=CC(=C3)C#N)O)C#N

InChI

InChI=1S/C16H9N5O/c17-8-11-2-1-3-13(6-11)14-10-21(20-19-14)15-7-12(9-18)4-5-16(15)22/h1-7,10,22H