Vitas-M small molecule compound
methyl 3-carbamoyl-5-nitrobenzoate
Catalog ID
STK395669
SMILES COC(=O)c1cc(cc(c1)C(=O)N)[N+](=O)[O-]
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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 C9H8N2O5 MW 224.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H8N2O5/c1-16-9(13)6-2-5(8(10)12)3-7(4-6)11(14)15/h2-4H,1H3,(H2,10,12)InChIKey
FUXUMOOJLAEGAX-UHFFFAOYSA-NSynonyms
50826-00-150826001
5NITROISOPHTHALAMICACIDMETHYLESTER
BENZOICACID3(AMINOCARBONYL)5NITROMETHYLESTER
COC(=O)C1=CC(=CC(=C1)C(=O)N)(N+)(=O)(O)
COC(=O)c1cc(cc(c1)C(=O)N)(N+)(=O)(O)
InChI=1SC9H8N2O5c1169(13)625(8(10)12)37(46)11(14)15h24H1H3(H21012)
methyl3carbamoyl5nitrobenzoate
METHYL5CARBAMOYL3NITROBENZOATE
MFCD00458620
ZINC000003163560
ZINC03163560
ZINC3163560
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