Vitas-M small molecule compound

4-acetyl-1-hexyl-3-hydroxy-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one

Catalog ID
STK999845
SMILES CCCCCCN1C(c2cccc(c2)[N+](=O)[O-])C(=C(C1=O)O)C(=O)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 C18H22N2O5 MW 346.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O5/c1-3-4-5-6-10-19-16(15(12(2)21)17(22)18(19)23)13-8-7-9-14(11-13)20(24)25/h7-9,11,16,22H,3-6,10H2,1-2H3
InChIKey
KBDYMVJKPZEWRG-UHFFFAOYSA-N
Synonyms
317324-16-6
317324166
3ACETYL1HEXYL4HYDROXY2(3NITROPHENYL)2HPYRROL5ONE
4acetyl1hexyl3hydroxy5(3nitrophenyl)15dihydro2Hpyrrol2one
4ACETYL1HEXYL3HYDROXY5(3NITROPHENYL)15DIHYDROPYRROL2ONE
4acetyl1hexyl3hydroxy5(3nitrophenyl)1Hpyrrol2(5H)one
CCCCCCN1C(C(=C(C1=O)O)C(=O)C)C2=CC(=CC=C2)(N+)(=O)(O)
CCCCCCN1C(c2cccc(c2)(N+)(=O)(O))C(=C(C1=O)O)C(=O)C
InChI=1SC18H22N2O5c13456101916(15(12(2)21)17(22)18(19)23)1387914(1113)20(24)25h79111622H3610H212H3
MFCD01541665
ZINC000004853383
ZINC000004853385

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Available files

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