Vitas-M small molecule compound
cyclohexylmethyl 2-methyl-4-(2-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Catalog ID
STK406327
SMILES O=C1NC(=C(C(C1)c1ccccc1[N+](=O)[O-])C(=O)OCC1CCCCC1)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 C20H24N2O5 MW 372.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N2O5/c1-13-19(20(24)27-12-14-7-3-2-4-8-14)16(11-18(23)21-13)15-9-5-6-10-17(15)22(25)26/h5-6,9-10,14,16H,2-4,7-8,11-12H2,1H3,(H,21,23)InChIKey
XYVXQYURIQQQQP-UHFFFAOYSA-NSynonyms
CC1=C(C(CC(=O)N1)C2=CC=CC=C2(N+)(=O)(O))C(=O)OCC3CCCCC3
cyclohexylmethyl2methyl4(2nitrophenyl)6oxo1456tetrahydropyridine3carboxylate
CYCLOHEXYLMETHYL2METHYL4(2NITROPHENYL)6OXO145TRIHYDROPYRIDINE3CARBOXYLATE
cyclohexylmethyl6methyl4(2nitrophenyl)2oxo34dihydro1Hpyridine5carboxylate
InChI=1SC20H24N2O5c11319(20(24)2712147324814)16(1118(23)2113)159561017(15)22(25)26h569101416H24781112H21H3(H2123)
MFCD06759510
ZINC000007342033
ZINC000007342034
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