3-nitro-4-[(1-phenylbenzotriazol-5-yl)amino]benzenecarbonitrile

Systemtic Name: 3-nitro-4-[(1-phenylbenzotriazol-5-yl)amino]benzenecarbonitrile Openeye Name: 3-nitro-4-[(1-phenylbenzotriazol-5-yl)amino]benzonitrile CAS Name: 3-nitro-4-[(1-phenyl-5-benzotriazolyl)amino]benzonitrile IUPAC Name: 3-nitro-4-[(1-phenylbenzotriazol-5-yl)amino]benzonitrile Traditional Name: 3-nitro-4-[(1-phenylbenzotriazol-5-yl)amino]benzonitrile Formula: C19H12N6O2 MolecularWeight: 356.33758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=C(C=C3)NC4=C(C=C(C=C4)C#N)[N+](=O)[O-])N=N2

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=C(C=C3)NC4=C(C=C(C=C4)C#N)[N+](=O)[O-])N=N2

InChI

InChI=1S/C19H12N6O2/c20-12-13-6-8-16(19(10-13)25(26)27)21-14-7-9-18-17(11-14)22-23-24(18)15-4-2-1-3-5-15/h1-11,21H