4-(3-methylbenzotriazol-5-yl)oxy-3-(1,2,4-triazol-1-ylmethyl)benzenecarbonitrile

Systemtic Name: 4-(3-methylbenzotriazol-5-yl)oxy-3-(1,2,4-triazol-1-ylmethyl)benzenecarbonitrile Openeye Name: 4-(3-methylbenzotriazol-5-yl)oxy-3-(1,2,4-triazol-1-ylmethyl)benzonitrile CAS Name: 4-[(3-methyl-5-benzotriazolyl)oxy]-3-(1,2,4-triazol-1-ylmethyl)benzonitrile IUPAC Name: 4-(3-methylbenzotriazol-5-yl)oxy-3-(1,2,4-triazol-1-ylmethyl)benzonitrile Traditional Name: 4-(3-methylbenzotriazol-5-yl)oxy-3-(1,2,4-triazol-1-ylmethyl)benzonitrile Formula: C17H13N7O MolecularWeight: 331.33142

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)OC3=C(C=C(C=C3)C#N)CN4C=NC=N4)N=N1

Isomeric SMILES

CN1C2=C(C=CC(=C2)OC3=C(C=C(C=C3)C#N)CN4C=NC=N4)N=N1

InChI

InChI=1S/C17H13N7O/c1-23-16-7-14(3-4-15(16)21-22-23)25-17-5-2-12(8-18)6-13(17)9-24-11-19-10-20-24/h2-7,10-11H,9H2,1H3