Vitas-M small molecule compound
2-[(cyanoacetyl)amino]ethyl benzoate
Catalog ID
STK438727
SMILES N#CCC(=O)NCCOC(=O)c1ccccc1
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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 C12H12N2O3 MW 232.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N2O3/c13-7-6-11(15)14-8-9-17-12(16)10-4-2-1-3-5-10/h1-5H,6,8-9H2,(H,14,15)InChIKey
XYBADTXDFVSWTJ-UHFFFAOYSA-NSynonyms
2((2CYANOACETYL)AMINO)ETHYLBENZOATE
2((cyanoacetyl)amino)ethylbenzoate
2(2CYANOACETYLAMINO)ETHYLBENZOATE
C1=CC=C(C=C1)C(=O)OCCNC(=O)CC#N
InChI=1SC12H12N2O3c137611(15)14891712(16)104213510h15H689H2(H1415)
MFCD03945526
ZINC000006252014
ZINC06252014
ZINC6252014
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