4-[(6-oxidanyl-1-benzofuran-2-yl)-(1,2,4-triazol-1-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(6-oxidanyl-1-benzofuran-2-yl)-(1,2,4-triazol-1-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(6-hydroxybenzofuran-2-yl)-(1,2,4-triazol-1-yl)methyl]benzonitrile CAS Name: 4-[(6-hydroxy-2-benzofuranyl)-(1,2,4-triazol-1-yl)methyl]benzonitrile IUPAC Name: 4-[(6-hydroxy-1-benzofuran-2-yl)-(1,2,4-triazol-1-yl)methyl]benzonitrile Traditional Name: 4-[(6-hydroxybenzofuran-2-yl)-(1,2,4-triazol-1-yl)methyl]benzonitrile Formula: C18H12N4O2 MolecularWeight: 316.31348

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(C2=CC3=C(O2)C=C(C=C3)O)N4C=NC=N4

Isomeric SMILES

C1=CC(=CC=C1C#N)C(C2=CC3=C(O2)C=C(C=C3)O)N4C=NC=N4

InChI

InChI=1S/C18H12N4O2/c19-9-12-1-3-13(4-2-12)18(22-11-20-10-21-22)17-7-14-5-6-15(23)8-16(14)24-17/h1-8,10-11,18,23H