Vitas-M small molecule compound
N-[3-(4-tert-butylphenoxy)-2-hydroxypropyl]-4-methoxy-N-methyl-3-nitrobenzamide
Catalog ID
STK133746
SMILES COc1ccc(cc1[N+](=O)[O-])C(=O)N(CC(COc1ccc(cc1)C(C)(C)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 C22H28N2O6 MW 416.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N2O6/c1-22(2,3)16-7-9-18(10-8-16)30-14-17(25)13-23(4)21(26)15-6-11-20(29-5)19(12-15)24(27)28/h6-12,17,25H,13-14H2,1-5H3InChIKey
MSOYAUHCMPGQQW-UHFFFAOYSA-NSynonyms
CC(C)(C)C1=CC=C(C=C1)OCC(CN(C)C(=O)C2=CC(=C(C=C2)OC)(N+)(=O)(O))O
COc1ccc(cc1(N+)(=O)(O))C(=O)N(CC(COc1ccc(cc1)C(C)(C)C)O)C
InChI=1SC22H28N2O6c122(23)167918(10816)301417(25)1323(4)21(26)1561120(295)19(1215)24(27)28h6121725H1314H215H3
MFCD08678371
N(3(4TERTBUTYLPHENOXY)2HYDROXYPROPYL)4METHOXYNMETHYL3NITROBENZAMIDE
ZINC000004680802
ZINC000004680803
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