Vitas-M small molecule compound
(3-acetyl-6-ethoxy-4-oxidoquinoxalin-2-yl)methyl 4-nitrobenzoate
Catalog ID
STK568614
SMILES CCOc1ccc2c(c1)[n+]([O-])c(c(n2)COC(=O)c1ccc(cc1)[N+](=O)[O-])C(=O)C
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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 C20H17N3O7 MW 411.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O7/c1-3-29-15-8-9-16-18(10-15)22(26)19(12(2)24)17(21-16)11-30-20(25)13-4-6-14(7-5-13)23(27)28/h4-10H,3,11H2,1-2H3InChIKey
BUHJLPONOYSFLW-UHFFFAOYSA-NSynonyms
714937-31-2(3acetyl6ethoxy4oxidoquinoxalin2yl)methyl4nitrobenzoate
(3ACETYL6ETHOXY4OXIDOQUINOXALIN4IUM2YL)METHYL4NITROBENZOATE
2acetyl7ethoxy3(((4nitrobenzoyl)oxy)methyl)quinoxaline1oxide
714937312
CCOC1=CC2=C(C=C1)N=C(C(=(N+)2(O))C(=O)C)COC(=O)C3=CC=C(C=C3)(N+)(=O)(O)
CCOc1ccc2c(c1)(n+)((O))c(c(n2)COC(=O)c1ccc(cc1)(N+)(=O)(O))C(=O)C
InChI=1SC20H17N3O7c132915891618(1015)22(26)19(12(2)24)17(2116)113020(25)134614(7513)23(27)28h410H311H212H3
MFCD05693973
ZINC000005529699
ZINC05529699
ZINC5529699
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