Vitas-M small molecule compound

2,1,3-benzoxadiazole-5-carboxamide 3-oxide

Catalog ID
STK537412
SMILES [O-][n+]1onc2c1cc(cc2)C(=O)N

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C7H5N3O3 MW 179.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C7H5N3O3/c8-7(11)4-1-2-5-6(3-4)10(12)13-9-5/h1-3H,(H2,8,11)
InChIKey
RSDUWLCEDYAVER-UHFFFAOYSA-N
Synonyms

(O)(n+)1onc2c1cc(cc2)C(=O)N
213benzoxadiazole5carboxamide3oxide
3OXIDO213BENZOXADIAZOL3IUM5CARBOXAMIDE
6carbamoylbenzo(c)(125)oxadiazole1oxide
C1=CC2=NO(N+)(=C2C=C1C(=O)N)(O)
InChI=1SC7H5N3O3c87(11)41256(34)10(12)1395h13H(H2811)
MFCD02997589
ZINC000000520026
ZINC00520026
ZINC520026

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.