Vitas-M small molecule compound
N-(2-methyl-5-nitrophenyl)-2-oxo-1-oxaspiro[4.5]decane-4-carboxamide
Catalog ID
STK993145
SMILES O=C(C1CC(=O)OC21CCCCC2)Nc1cc(ccc1C)[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 C17H20N2O5 MW 332.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N2O5/c1-11-5-6-12(19(22)23)9-14(11)18-16(21)13-10-15(20)24-17(13)7-3-2-4-8-17/h5-6,9,13H,2-4,7-8,10H2,1H3,(H,18,21)InChIKey
NWCIHXMDXCKTNA-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)(N+)(=O)(O))NC(=O)C2CC(=O)OC23CCCCC3
InChI=1SC17H20N2O5c1115612(19(22)23)914(11)1816(21)131015(20)2417(13)7324817h56913H247810H21H3(H1821)
MFCD03192722
N(2methyl5nitrophenyl)2oxo1oxaspiro(45)decane4carboxamide
N(2METHYL5NITROPHENYL)3OXO4OXASPIRO(45)DECANE1CARBOXAMIDE
O=C(C1CC(=O)OC21CCCCC2)Nc1cc(ccc1C)(N+)(=O)(O)
ZINC000000309138
ZINC000000309139
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