Vitas-M small molecule compound

N-(2-methoxy-4-nitrophenyl)-3-phenylbutanamide

Catalog ID
STK076977
SMILES COc1cc(ccc1NC(=O)CC(c1ccccc1)C)[N+](=O)[O-]

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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 C17H18N2O4 MW 314.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O4/c1-12(13-6-4-3-5-7-13)10-17(20)18-15-9-8-14(19(21)22)11-16(15)23-2/h3-9,11-12H,10H2,1-2H3,(H,18,20)
InChIKey
LTNWLFRWYJGIEQ-UHFFFAOYSA-N
Synonyms
432528-02-4
432528024
CC(CC(=O)NC1=C(C=C(C=C1)(N+)(=O)(O))OC)C2=CC=CC=C2
COc1cc(ccc1NC(=O)CC(c1ccccc1)C)(N+)(=O)(O)
InChI=1SC17H18N2O4c112(136435713)1017(20)18159814(19(21)22)1116(15)232h391112H10H212H3(H1820)
MFCD03348297
N(2METHOXY4NITROPHENYL)3PHENYLBUTANAMIDE
STK076977
ZINC000004600563
ZINC000004600564

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Available files

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