Vitas-M small molecule compound
N-[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]-4-methoxy-3-nitrobenzamide
Catalog ID
STK519752
SMILES COc1ccc(cc1NC(=O)c1ccc(c(c1)[N+](=O)[O-])OC)c1nc2c(o1)cccc2
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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 C22H17N3O6 MW 419.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O6/c1-29-18-9-8-14(22-24-15-5-3-4-6-19(15)31-22)11-16(18)23-21(26)13-7-10-20(30-2)17(12-13)25(27)28/h3-12H,1-2H3,(H,23,26)InChIKey
APXPHIRQFHINRR-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3O2)NC(=O)C4=CC(=C(C=C4)OC)(N+)(=O)(O)
COc1ccc(cc1NC(=O)c1ccc(c(c1)(N+)(=O)(O))OC)c1nc2c(o1)cccc2
InChI=1SC22H17N3O6c129189814(222415534619(15)3122)1116(18)2321(26)1371020(302)17(1213)25(27)28h312H12H3(H2326)
MFCD05850644
N(5(13benzoxazol2yl)2methoxyphenyl)4methoxy3nitrobenzamide
ZINC000002883228
ZINC02883228
ZINC2883228
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