Vitas-M small molecule compound
2-(propan-2-yloxy)ethyl 2-methyl-4-(2-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Catalog ID
STK406387
SMILES O=C1NC(=C(C(C1)c1ccccc1[N+](=O)[O-])C(=O)OCCOC(C)C)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 C18H22N2O6 MW 362.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O6/c1-11(2)25-8-9-26-18(22)17-12(3)19-16(21)10-14(17)13-6-4-5-7-15(13)20(23)24/h4-7,11,14H,8-10H2,1-3H3,(H,19,21)InChIKey
KDGMPIROECTBJA-UHFFFAOYSA-NSynonyms
2(METHYLETHOXY)ETHYL2METHYL4(2NITROPHENYL)6OXO145TRIHYDROPYRIDINE3CARBOXYLATE
2(propan2yloxy)ethyl2methyl4(2nitrophenyl)6oxo1456tetrahydropyridine3carboxylate
2propan2yloxyethyl6methyl4(2nitrophenyl)2oxo34dihydro1Hpyridine5carboxylate
CC1=C(C(CC(=O)N1)C2=CC=CC=C2(N+)(=O)(O))C(=O)OCCOC(C)C
InChI=1SC18H22N2O6c111(2)25892618(22)1712(3)1916(21)1014(17)13645715(13)20(23)24h471114H810H213H3(H1921)
MFCD06759566
O=C1NC(=C(C(C1)c1ccccc1(N+)(=O)(O))C(=O)OCCOC(C)C)C
ZINC000004913671
ZINC000004913674
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