Vitas-M small molecule compound
4-[5-benzyl-2-(3-nitrophenyl)-4,6-dioxohexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2-methoxyphenyl benzoate
Catalog ID
STL057355
SMILES COc1cc(ccc1OC(=O)c1ccccc1)C1C2C(=O)N(C(=O)C2ON1c1cccc(c1)[N+](=O)[O-])Cc1ccccc1
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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 C32H25N3O8 MW 579.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H25N3O8/c1-41-26-17-22(15-16-25(26)42-32(38)21-11-6-3-7-12-21)28-27-29(43-34(28)23-13-8-14-24(18-23)35(39)40)31(37)33(30(27)36)19-20-9-4-2-5-10-20/h2-18,27-29H,19H2,1H3InChIKey
NFRUHNDXORRJRJ-UHFFFAOYSA-NSynonyms
(4(5BENZYL2(3NITROPHENYL)46DIOXO3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL3YL)2METHOXYPHENYL)BENZOATE
4(5benzyl2(3nitrophenyl)46dioxohexahydro2Hpyrrolo(34d)(12)oxazol3yl)2methoxyphenylbenzoate
4(5benzyl2(3nitrophenyl)46dioxohexahydro2Hpyrrolo(34d)isoxazol3yl)2methoxyphenylbenzoate
COC1=C(C=CC(=C1)C2C3C(C(=O)N(C3=O)CC4=CC=CC=C4)ON2C5=CC(=CC=C5)(N+)(=O)(O))OC(=O)C6=CC=CC=C6
COc1cc(ccc1OC(=O)c1ccccc1)C1C2C(=O)N(C(=O)C2ON1c1cccc(c1)(N+)(=O)(O))Cc1ccccc1
InChI=1SC32H25N3O8c141261722(151625(26)4232(38)21116371221)282729(4334(28)231381424(1823)35(39)40)31(37)33(30(27)36)192094251020h2182729H19H21H3
MFCD05725976
ZINC000102899455
ZINC000106021098
Check stock
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Check stock on Vitas-MAvailable files
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