Vitas-M small molecule compound

N-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]-2-phenoxybutanamide

Catalog ID
STK451264
SMILES CCC(C(=O)Nc1cc(OCC(F)(F)F)cc(c1)[N+](=O)[O-])Oc1ccccc1

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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 C18H17F3N2O5 MW 398.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17F3N2O5/c1-2-16(28-14-6-4-3-5-7-14)17(24)22-12-8-13(23(25)26)10-15(9-12)27-11-18(19,20)21/h3-10,16H,2,11H2,1H3,(H,22,24)
InChIKey
KZWDUDGTQRZQAW-UHFFFAOYSA-N
Synonyms

CCC(C(=O)NC1=CC(=CC(=C1)OCC(F)(F)F)(N+)(=O)(O))OC2=CC=CC=C2
CCC(C(=O)Nc1cc(OCC(F)(F)F)cc(c1)(N+)(=O)(O))Oc1ccccc1
InChI=1SC18H17F3N2O5c1216(28146435714)17(24)2212813(23(25)26)1015(912)271118(1920)21h31016H211H21H3(H2224)
MFCD03071798
N(3nitro5(222trifluoroethoxy)phenyl)2phenoxybutanamide
ZINC000002761354
ZINC000002761355

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.