Vitas-M small molecule compound

[3-(4-nitrophenyl)-1H-1,2,4-triazol-5-yl]acetic acid

Catalog ID
STK870420
SMILES OC(=O)Cc1[nH]nc(n1)c1ccc(cc1)[N+](=O)[O-]

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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 C10H8N4O4 MW 248.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H8N4O4/c15-9(16)5-8-11-10(13-12-8)6-1-3-7(4-2-6)14(17)18/h1-4H,5H2,(H,15,16)(H,11,12,13)
InChIKey
PUDWBRMRYFQHKH-UHFFFAOYSA-N
Synonyms
197293-86-0
(3(4nitrophenyl)1H124triazol5yl)aceticacid
(5(4NITROPHENYL)2H(124)TRIAZOL3YL)ACETICACID
197293860
2(3(4NITROPHENYL)1H124TRIAZOL5YL)ACETICACID
C1=CC(=CC=C1C2=NNC(=N2)CC(=O)O)(N+)(=O)(O)
InChI=1SC10H8N4O4c159(16)581110(13128)6137(426)14(17)18h14H5H2(H1516)(H111213)
MFCD11983296
OC(=O)Cc1(nH)nc(n1)c1ccc(cc1)(N+)(=O)(O)
ZINC000014951278
ZINC14951278

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Available files

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