Vitas-M small molecule compound

(3-acetyl-6-methoxy-4-oxidoquinoxalin-2-yl)methyl 3,5-dimethoxybenzoate

Catalog ID
STL239189
SMILES COc1cc(OC)cc(c1)C(=O)OCc1nc2ccc(cc2[n+](c1C(=O)C)[O-])OC

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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)20-18(22-17-6-5-14(27-2)10-19(17)23(20)26)11-30-21(25)13-7-15(28-3)9-16(8-13)29-4/h5-10H,11H2,1-4H3
InChIKey
FQATZLUAZKXJQS-UHFFFAOYSA-N
Synonyms
861652-39-3
(3ACETYL6METHOXY4OXIDO2QUINOXALINYL)METHYL35DIMETHOXYBENZOATE
(3acetyl6methoxy4oxidoquinoxalin2yl)methyl35dimethoxybenzoate
(3ACETYL6METHOXY4OXIDOQUINOXALIN4IUM2YL)METHYL35DIMETHOXYBENZOATE
2acetyl3(((35dimethoxybenzoyl)oxy)methyl)7methoxyquinoxaline1oxide
861652393
CC(=O)C1=(N+)(C2=C(C=CC(=C2)OC)N=C1COC(=O)C3=CC(=CC(=C3)OC)OC)(O)
COc1cc(OC)cc(c1)C(=O)OCc1nc2ccc(cc2(n+)(c1C(=O)C)(O))OC
InChI=1SC21H20N2O7c112(24)2018(22176514(272)1019(17)23(20)26)113021(25)13715(283)916(813)294h510H11H214H3
MFCD05686578
ZINC000005500020
ZINC05500020
ZINC5500020

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Available files

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