Vitas-M small molecule compound

2-(4-nitrophenyl)-2-oxoethyl 2-methoxybenzoate

Catalog ID
STK388187
SMILES COc1ccccc1C(=O)OCC(=O)c1ccc(cc1)[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 C16H13NO6 MW 315.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13NO6/c1-22-15-5-3-2-4-13(15)16(19)23-10-14(18)11-6-8-12(9-7-11)17(20)21/h2-9H,10H2,1H3
InChIKey
UFICAKQOIWBEHB-UHFFFAOYSA-N
Synonyms
294873-28-2
(2(4NITROPHENYL)2OXOETHYL)2METHOXYBENZOATE
2(4NITROPHENYL)2OXOETHYL2METHOXYBENZOATE
294873282
2METHOXYBENZOICACID2(4NITROPHENYL)2OXOETHYLESTER
COC1=CC=CC=C1C(=O)OCC(=O)C2=CC=C(C=C2)(N+)(=O)(O)
COc1ccccc1C(=O)OCC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC16H13NO6c12215532413(15)16(19)231014(18)116812(9711)17(20)21h29H10H21H3
MFCD00391931
ZINC000000062309
ZINC00062309
ZINC62309

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Available files

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