Vitas-M small molecule compound
3-{[(4-methyl-2-nitrophenoxy)acetyl]amino}benzoic acid
Catalog ID
STK244334
SMILES O=C(Nc1cccc(c1)C(=O)O)COc1ccc(cc1[N+](=O)[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 C16H14N2O6 MW 330.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N2O6/c1-10-5-6-14(13(7-10)18(22)23)24-9-15(19)17-12-4-2-3-11(8-12)16(20)21/h2-8H,9H2,1H3,(H,17,19)(H,20,21)InChIKey
ZQBQHOBHRNMNER-UHFFFAOYSA-NSynonyms
3(((4methyl2nitrophenoxy)acetyl)amino)benzoicacid
3((2(4methyl2nitrophenoxy)acetyl)amino)benzoicacid
CC1=CC(=C(C=C1)OCC(=O)NC2=CC=CC(=C2)C(=O)O)(N+)(=O)(O)
InChI=1SC16H14N2O6c1105614(13(710)18(22)23)24915(19)171242311(812)16(20)21h28H9H21H3(H1719)(H2021)
MFCD07113455
O=C(Nc1cccc(c1)C(=O)O)COc1ccc(cc1(N+)(=O)(O))C
ZINC000013843286
ZINC13843286
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