Vitas-M small molecule compound
3,4-dichloro-N-{3-methoxy-4-[(4-nitrobenzyl)oxy]benzyl}aniline
Catalog ID
STL484730
SMILES COc1cc(ccc1OCc1ccc(cc1)[N+](=O)[O-])CNc1ccc(c(c1)Cl)Cl
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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 C21H18Cl2N2O4 MW 433.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18Cl2N2O4/c1-28-21-10-15(12-24-16-5-8-18(22)19(23)11-16)4-9-20(21)29-13-14-2-6-17(7-3-14)25(26)27/h2-11,24H,12-13H2,1H3InChIKey
PKDBBQKOTCEBGP-UHFFFAOYSA-NSynonyms
34DICHLORON((3METHOXY4((4NITROPHENYL)METHOXY)PHENYL)METHYL)ANILINE
34DICHLORON(3METHOXY4((4NITROBENZYL)OXY)BENZYL)ANILINE
COC1=C(C=CC(=C1)CNC2=CC(=C(C=C2)Cl)Cl)OCC3=CC=C(C=C3)(N+)(=O)(O)
COc1cc(ccc1OCc1ccc(cc1)(N+)(=O)(O))CNc1ccc(c(c1)Cl)Cl
InChI=1SC21H18Cl2N2O4c128211015(1224165818(22)19(23)1116)4920(21)2913142617(7314)25(26)27h21124H1213H21H3
MFCD05987218
ZINC000002845739
ZINC02845739
ZINC2845739
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