4-(benzotriazol-1-yl)-5-(4-methylphenoxy)benzene-1,2-dicarbonitrile

Systemtic Name: 4-(benzotriazol-1-yl)-5-(4-methylphenoxy)benzene-1,2-dicarbonitrile Openeye Name: 4-(benzotriazol-1-yl)-5-(4-methylphenoxy)phthalonitrile CAS Name: 4-(1-benzotriazolyl)-5-(4-methylphenoxy)benzene-1,2-dicarbonitrile IUPAC Name: 4-(benzotriazol-1-yl)-5-(4-methylphenoxy)benzene-1,2-dicarbonitrile Traditional Name: 4-(benzotriazol-1-yl)-5-(4-methylphenoxy)phthalonitrile Formula: C21H13N5O MolecularWeight: 351.36082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=C(C=C(C(=C2)C#N)C#N)N3C4=CC=CC=C4N=N3

Isomeric SMILES

CC1=CC=C(C=C1)OC2=C(C=C(C(=C2)C#N)C#N)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C21H13N5O/c1-14-6-8-17(9-7-14)27-21-11-16(13-23)15(12-22)10-20(21)26-19-5-3-2-4-18(19)24-25-26/h2-11H,1H3