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benzotriazol-1-yl-(3,5-dinitrophenyl)methanone

benzotriazol-1-yl-(3,5-dinitrophenyl)methanone

Systemtic Name:benzotriazol-1-yl-(3,5-dinitrophenyl)methanone
Openeye Name:benzotriazol-1-yl-(3,5-dinitrophenyl)methanone
CAS Name:1-benzotriazolyl-(3,5-dinitrophenyl)methanone
IUPAC Name:benzotriazol-1-yl-(3,5-dinitrophenyl)methanone
Traditional Name:benzotriazol-1-yl-(3,5-dinitrophenyl)methanone
Formula: C13H7N5O5
MolecularWeight: 313.22518
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]


Isomeric SMILES

C1=CC=C2C(=C1)N=NN2C(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]


InChI

InChI=1S/C13H7N5O5/c19-13(16-12-4-2-1-3-11(12)14-15-16)8-5-9(17(20)21)7-10(6-8)18(22)23/h1-7H


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