Vitas-M small molecule compound

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

Catalog ID
STK762238
SMILES Oc1ccc(cc1)N1C(c2ccc(cc2)[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 C18H14N2O6 MW 354.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N2O6/c1-10(21)15-16(11-2-4-13(5-3-11)20(25)26)19(18(24)17(15)23)12-6-8-14(22)9-7-12/h2-9,16,22-23H,1H3
InChIKey
XAKNGHUXWZKUJR-UHFFFAOYSA-N
Synonyms
309738-55-4
309738554
3ACETYL4HYDROXY1(4HYDROXYPHENYL)2(4NITROPHENYL)2HPYRROL5ONE
4ACETYL3HYDROXY1(4HYDROXYPHENYL)5(4NITROPHENYL)15DIHYDRO2HPYRROL2ONE
4acetyl3hydroxy1(4hydroxyphenyl)5(4nitrophenyl)1Hpyrrol2(5H)one
CC(=O)C1=C(C(=O)N(C1C2=CC=C(C=C2)(N+)(=O)(O))C3=CC=C(C=C3)O)O
InChI=1SC18H14N2O6c110(21)1516(112413(5311)20(25)26)19(18(24)17(15)23)126814(22)9712h29162223H1H3
MFCD01872712
Oc1ccc(cc1)N1C(c2ccc(cc2)(N+)(=O)(O))C(=C(C1=O)O)C(=O)C
ZINC000000847045
ZINC000000847046

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Available files

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