Vitas-M small molecule compound
2-(2-methoxy-5-nitrophenyl)-5-(4-oxo-4H-3,1-benzoxazin-2-yl)-1H-isoindole-1,3(2H)-dione
Catalog ID
STK292474
SMILES COc1ccc(cc1N1C(=O)c2c(C1=O)cc(cc2)c1nc2ccccc2c(=O)o1)[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 C23H13N3O7 MW 443.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H13N3O7/c1-32-19-9-7-13(26(30)31)11-18(19)25-21(27)14-8-6-12(10-16(14)22(25)28)20-24-17-5-3-2-4-15(17)23(29)33-20/h2-11H,1H3InChIKey
WEIYMNDMKCDMTF-UHFFFAOYSA-NSynonyms
402579-50-42(2METHOXY5NITROPHENYL)5(4OXO31BENZOXAZIN2YL)ISOINDOLE13DIONE
2(2methoxy5nitrophenyl)5(4oxo4H31benzoxazin2yl)1Hisoindole13(2H)dione
2(2methoxy5nitrophenyl)5(4oxo4Hbenzo(d)(13)oxazin2yl)isoindoline13dione
402579504
COC1=C(C=C(C=C1)(N+)(=O)(O))N2C(=O)C3=C(C2=O)C=C(C=C3)C4=NC5=CC=CC=C5C(=O)O4
COc1ccc(cc1N1C(=O)c2c(C1=O)cc(cc2)c1nc2ccccc2c(=O)o1)(N+)(=O)(O)
InChI=1SC23H13N3O7c132199713(26(30)31)1118(19)2521(27)148612(1016(14)22(25)28)202417532415(17)23(29)3320h211H1H3
MFCD02031540
ZINC000009186600
ZINC09186600
ZINC9186600
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