Vitas-M small molecule compound

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

Catalog ID
STL000448
SMILES OCCCN1C(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 C15H16N2O6 MW 320.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N2O6/c1-9(19)12-13(10-4-2-5-11(8-10)17(22)23)16(6-3-7-18)15(21)14(12)20/h2,4-5,8,13,18,20H,3,6-7H2,1H3
InChIKey
KRKOVHMSQCEHRU-UHFFFAOYSA-N
Synonyms
296769-94-3
296769943
3ACETYL4HYDROXY1(3HYDROXYPROPYL)2(3NITROPHENYL)2HPYRROL5ONE
4acetyl3hydroxy1(3hydroxypropyl)5(3nitrophenyl)15dihydro2Hpyrrol2one
4acetyl3hydroxy1(3hydroxypropyl)5(3nitrophenyl)1Hpyrrol2(5H)one
CC(=O)C1=C(C(=O)N(C1C2=CC(=CC=C2)(N+)(=O)(O))CCCO)O
InChI=1SC15H16N2O6c19(19)1213(1042511(810)17(22)23)16(63718)15(21)14(12)20h2458131820H367H21H3
MFCD00820637
OCCCN1C(c2cccc(c2)(N+)(=O)(O))C(=C(C1=O)O)C(=O)C
ZINC000005668937
ZINC000018152041

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Available files

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