1-[benzotriazol-1-yl-(3,4-dinitrophenyl)methyl]benzotriazole

Systemtic Name: 1-[benzotriazol-1-yl-(3,4-dinitrophenyl)methyl]benzotriazole Openeye Name: 1-[benzotriazol-1-yl-(3,4-dinitrophenyl)methyl]benzotriazole CAS Name: 1-[1-benzotriazolyl-(3,4-dinitrophenyl)methyl]benzotriazole IUPAC Name: 1-[benzotriazol-1-yl-(3,4-dinitrophenyl)methyl]benzotriazole Traditional Name: 1-[benzotriazol-1-yl-(3,4-dinitrophenyl)methyl]benzotriazole Formula: C19H12N8O4 MolecularWeight: 416.34978

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C(C3=CC(=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])N4C5=CC=CC=C5N=N4

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2C(C3=CC(=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])N4C5=CC=CC=C5N=N4

InChI

InChI=1S/C19H12N8O4/c28-26(29)17-10-9-12(11-18(17)27(30)31)19(24-15-7-3-1-5-13(15)20-22-24)25-16-8-4-2-6-14(16)21-23-25/h1-11,19H