Vitas-M small molecule compound

4-nitrophenyl 3,4,5-trimethoxybenzoate

Catalog ID
STK328262
SMILES COc1cc(cc(c1OC)OC)C(=O)Oc1ccc(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 C16H15NO7 MW 333.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15NO7/c1-21-13-8-10(9-14(22-2)15(13)23-3)16(18)24-12-6-4-11(5-7-12)17(19)20/h4-9H,1-3H3
InChIKey
QMGKPSZUERJCKZ-UHFFFAOYSA-N
Synonyms
69705-21-1
(4NITROPHENYL)345TRIMETHOXYBENZOATE
345TRIMETHOXYBENZOICACID4NITROPHENYLESTER
4nitrophenyl345trimethoxybenzoate
69705211
COC1=CC(=CC(=C1OC)OC)C(=O)OC2=CC=C(C=C2)(N+)(=O)(O)
COc1cc(cc(c1OC)OC)C(=O)Oc1ccc(cc1)(N+)(=O)(O)
InChI=1SC16H15NO7c12113810(914(222)15(13)233)16(18)24126411(5712)17(19)20h49H13H3
MFCD00388010
ZINC000000341384
ZINC00341384
ZINC341384

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Available files

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