Vitas-M small molecule compound
2-(4-methyl-3-nitrophenyl)-2-oxoethyl 2-hydroxy-3-methylbenzoate
Catalog ID
STK388191
SMILES O=C(c1ccc(c(c1)[N+](=O)[O-])C)COC(=O)c1cccc(c1O)C
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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 C17H15NO6 MW 329.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15NO6/c1-10-6-7-12(8-14(10)18(22)23)15(19)9-24-17(21)13-5-3-4-11(2)16(13)20/h3-8,20H,9H2,1-2H3InChIKey
NHSCRJVJGANFED-UHFFFAOYSA-NSynonyms
355152-12-4(2(4METHYL3NITROPHENYL)2OXOETHYL)2HYDROXY3METHYLBENZOATE
2(4METHYL3NITROPHENYL)2OXOETHYL2HYDROXY3METHYLBENZOATE
355152124
CC1=C(C=C(C=C1)C(=O)COC(=O)C2=C(C(=CC=C2)C)O)(N+)(=O)(O)
InChI=1SC17H15NO6c1106712(814(10)18(22)23)15(19)92417(21)1353411(2)16(13)20h3820H9H212H3
MFCD01823446
O=C(c1ccc(c(c1)(N+)(=O)(O))C)COC(=O)c1cccc(c1O)C
ZINC000000453344
ZINC00453344
ZINC453344
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