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

Systemtic Name: 4-(benzotriazol-1-yl)-5-(4-ethanoylphenoxy)benzene-1,2-dicarbonitrile Openeye Name: 4-(4-acetylphenoxy)-5-(benzotriazol-1-yl)phthalonitrile CAS Name: 4-(4-acetylphenoxy)-5-(1-benzotriazolyl)benzene-1,2-dicarbonitrile IUPAC Name: 4-(4-acetylphenoxy)-5-(benzotriazol-1-yl)benzene-1,2-dicarbonitrile Traditional Name: 4-(4-acetylphenoxy)-5-(benzotriazol-1-yl)phthalonitrile Formula: C22H13N5O2 MolecularWeight: 379.37092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H13N5O2/c1-14(28)15-6-8-18(9-7-15)29-22-11-17(13-24)16(12-23)10-21(22)27-20-5-3-2-4-19(20)25-26-27/h2-11H,1H3