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

Systemtic Name: 4-(benzotriazol-1-yl)-5-(4-nitrophenoxy)benzene-1,2-dicarbonitrile Openeye Name: 4-(benzotriazol-1-yl)-5-(4-nitrophenoxy)phthalonitrile CAS Name: 4-(1-benzotriazolyl)-5-(4-nitrophenoxy)benzene-1,2-dicarbonitrile IUPAC Name: 4-(benzotriazol-1-yl)-5-(4-nitrophenoxy)benzene-1,2-dicarbonitrile Traditional Name: 4-(benzotriazol-1-yl)-5-(4-nitrophenoxy)phthalonitrile Formula: C20H10N6O3 MolecularWeight: 382.3318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C3=C(C=C(C(=C3)C#N)C#N)OC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2C3=C(C=C(C(=C3)C#N)C#N)OC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H10N6O3/c21-11-13-9-19(25-18-4-2-1-3-17(18)23-24-25)20(10-14(13)12-22)29-16-7-5-15(6-8-16)26(27)28/h1-10H