2-[[4-nitro-5-(pyridin-2-ylamino)-2,1,3-benzoxadiazol-7-yl]amino]benzenecarbonitrile

Systemtic Name: 2-[[4-nitro-5-(pyridin-2-ylamino)-2,1,3-benzoxadiazol-7-yl]amino]benzenecarbonitrile Openeye Name: 2-[[4-nitro-5-(2-pyridylamino)-2,1,3-benzoxadiazol-7-yl]amino]benzonitrile CAS Name: 2-[[4-nitro-5-(2-pyridinylamino)-2,1,3-benzoxadiazol-7-yl]amino]benzonitrile IUPAC Name: 2-[[4-nitro-5-(pyridin-2-ylamino)-2,1,3-benzoxadiazol-7-yl]amino]benzonitrile Traditional Name: 2-[[7-nitro-6-(2-pyridylamino)benzofurazan-4-yl]amino]benzonitrile Formula: C18H11N7O3 MolecularWeight: 373.32504

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)NC2=CC(=C(C3=NON=C23)[N+](=O)[O-])NC4=CC=CC=N4

Isomeric SMILES

C1=CC=C(C(=C1)C#N)NC2=CC(=C(C3=NON=C23)[N+](=O)[O-])NC4=CC=CC=N4

InChI

InChI=1S/C18H11N7O3/c19-10-11-5-1-2-6-12(11)21-13-9-14(22-15-7-3-4-8-20-15)18(25(26)27)17-16(13)23-28-24-17/h1-9,21H,(H,20,22)