Vitas-M small molecule compound

(3-acetyl-4-oxidoquinoxalin-2-yl)methyl 3,4,5-trimethoxybenzoate

Catalog ID
STL239221
SMILES COc1cc(cc(c1OC)OC)C(=O)OCc1nc2ccccc2[n+](c1C(=O)C)[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 C21H20N2O7 MW 412.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O7/c1-12(24)19-15(22-14-7-5-6-8-16(14)23(19)26)11-30-21(25)13-9-17(27-2)20(29-4)18(10-13)28-3/h5-10H,11H2,1-4H3
InChIKey
BPARUCFACMZFGZ-UHFFFAOYSA-N
Synonyms
850235-45-9
(3acetyl4oxidoquinoxalin2yl)methyl345trimethoxybenzoate
(3ACETYL4OXIDOQUINOXALIN4IUM2YL)METHYL345TRIMETHOXYBENZOATE
2acetyl3(((345trimethoxybenzoyl)oxy)methyl)quinoxaline1oxide
850235459
CC(=O)C1=(N+)(C2=CC=CC=C2N=C1COC(=O)C3=CC(=C(C(=C3)OC)OC)OC)(O)
COc1cc(cc(c1OC)OC)C(=O)OCc1nc2ccccc2(n+)(c1C(=O)C)(O)
InChI=1SC21H20N2O7c112(24)1915(2214756816(14)23(19)26)113021(25)13917(272)20(294)18(1013)283h510H11H214H3
MFCD05691467
ZINC000002344381
ZINC02344381
ZINC2344381

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Available files

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