Vitas-M small molecule compound

2-(3-nitrophenyl)-2-oxoethyl 3,4,5-trimethoxybenzoate

Catalog ID
STK388167
SMILES COc1cc(cc(c1OC)OC)C(=O)OCC(=O)c1cccc(c1)[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 C18H17NO8 MW 375.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17NO8/c1-24-15-8-12(9-16(25-2)17(15)26-3)18(21)27-10-14(20)11-5-4-6-13(7-11)19(22)23/h4-9H,10H2,1-3H3
InChIKey
FDOVRHNSZISZGR-UHFFFAOYSA-N
Synonyms
312947-28-7
(2(3NITROPHENYL)2OXOETHYL)345TRIMETHOXYBENZOATE
2(3NITROPHENYL)2OXOETHYL345TRIMETHOXYBENZOATE
312947287
COC1=CC(=CC(=C1OC)OC)C(=O)OCC(=O)C2=CC(=CC=C2)(N+)(=O)(O)
COc1cc(cc(c1OC)OC)C(=O)OCC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC18H17NO8c12415812(916(252)17(15)263)18(21)271014(20)1154613(711)19(22)23h49H10H213H3
MFCD00619695
ZINC000001170379
ZINC01170379
ZINC1170379

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Available files

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