4,6-bis(benzotriazol-1-yl)-N-(3-nitrophenyl)-1,3,5-triazin-2-amine

Systemtic Name: 4,6-bis(benzotriazol-1-yl)-N-(3-nitrophenyl)-1,3,5-triazin-2-amine Openeye Name: 4,6-bis(benzotriazol-1-yl)-N-(3-nitrophenyl)-1,3,5-triazin-2-amine CAS Name: 4,6-bis(1-benzotriazolyl)-N-(3-nitrophenyl)-1,3,5-triazin-2-amine IUPAC Name: 4,6-bis(benzotriazol-1-yl)-N-(3-nitrophenyl)-1,3,5-triazin-2-amine Traditional Name: [4,6-bis(benzotriazol-1-yl)-s-triazin-2-yl]-(3-nitrophenyl)amine Formula: C21H13N11O2 MolecularWeight: 451.40042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C3=NC(=NC(=N3)NC4=CC(=CC=C4)[N+](=O)[O-])N5C6=CC=CC=C6N=N5

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2C3=NC(=NC(=N3)NC4=CC(=CC=C4)[N+](=O)[O-])N5C6=CC=CC=C6N=N5

InChI

InChI=1S/C21H13N11O2/c33-32(34)14-7-5-6-13(12-14)22-19-23-20(30-17-10-3-1-8-15(17)26-28-30)25-21(24-19)31-18-11-4-2-9-16(18)27-29-31/h1-12H,(H,22,23,24,25)