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(6-nitrobenzotriazol-1-yl) benzoate

(6-nitrobenzotriazol-1-yl) benzoate

Systemtic Name:(6-nitrobenzotriazol-1-yl) benzoate
Openeye Name:(6-nitrobenzotriazol-1-yl) benzoate
CAS Name:benzoic acid (6-nitro-1-benzotriazolyl) ester
IUPAC Name:(6-nitrobenzotriazol-1-yl) benzoate
Traditional Name:benzoic acid (6-nitrobenzotriazol-1-yl) ester
Formula: C13H8N4O4
MolecularWeight: 284.22702
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)ON2C3=C(C=CC(=C3)[N+](=O)[O-])N=N2


Isomeric SMILES

C1=CC=C(C=C1)C(=O)ON2C3=C(C=CC(=C3)[N+](=O)[O-])N=N2


InChI

InChI=1S/C13H8N4O4/c18-13(9-4-2-1-3-5-9)21-16-12-8-10(17(19)20)6-7-11(12)14-15-16/h1-8H


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