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(6-chloranylbenzotriazol-1-yl) 4-nitrobenzoate

(6-chloranylbenzotriazol-1-yl) 4-nitrobenzoate

Systemtic Name:(6-chloranylbenzotriazol-1-yl) 4-nitrobenzoate
Openeye Name:(6-chlorobenzotriazol-1-yl) 4-nitrobenzoate
CAS Name:4-nitrobenzoic acid (6-chloro-1-benzotriazolyl) ester
IUPAC Name:(6-chlorobenzotriazol-1-yl) 4-nitrobenzoate
Traditional Name:4-nitrobenzoic acid (6-chlorobenzotriazol-1-yl) ester
Formula: C13H7ClN4O4
MolecularWeight: 318.67208
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)ON2C3=C(C=CC(=C3)Cl)N=N2)[N+](=O)[O-]


Isomeric SMILES

C1=CC(=CC=C1C(=O)ON2C3=C(C=CC(=C3)Cl)N=N2)[N+](=O)[O-]


InChI

InChI=1S/C13H7ClN4O4/c14-9-3-6-11-12(7-9)17(16-15-11)22-13(19)8-1-4-10(5-2-8)18(20)21/h1-7H


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