Vitas-M small molecule compound
5-chloro-4-[(cyanoacetyl)amino]-2-methoxybenzoic acid
Catalog ID
STK317972
SMILES COc1cc(NC(=O)CC#N)c(cc1C(=O)O)Cl
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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 C11H9ClN2O4 MW 268.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H9ClN2O4/c1-18-9-5-8(14-10(15)2-3-13)7(12)4-6(9)11(16)17/h4-5H,2H2,1H3,(H,14,15)(H,16,17)InChIKey
SZVCTXYTTJOURG-UHFFFAOYSA-NSynonyms
5chloro4((2cyanoacetyl)amino)2methoxybenzoicacid
5chloro4((cyanoacetyl)amino)2methoxybenzoicacid
COC1=CC(=C(C=C1C(=O)O)Cl)NC(=O)CC#N
InChI=1SC11H9ClN2O4c118958(1410(15)2313)7(12)46(9)11(16)17h45H2H21H3(H1415)(H1617)
MFCD09961402
ZINC000012650256
ZINC12650256
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