Vitas-M small molecule compound
5-(7-chloro-4-oxo-4H-3,1-benzoxazin-2-yl)-2-(3-nitrophenyl)-1H-isoindole-1,3(2H)-dione
Catalog ID
STK075004
SMILES Clc1ccc2c(c1)nc(oc2=O)c1ccc2c(c1)C(=O)N(C2=O)c1cccc(c1)[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 C22H10ClN3O6 MW 447.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H10ClN3O6/c23-12-5-7-16-18(9-12)24-19(32-22(16)29)11-4-6-15-17(8-11)21(28)25(20(15)27)13-2-1-3-14(10-13)26(30)31/h1-10HInChIKey
YYUILUROWSVTAA-UHFFFAOYSA-NSynonyms
5(7CHLORO4OXO31BENZOXAZIN2YL)2(3NITROPHENYL)ISOINDOLE13DIONE
5(7CHLORO4OXO4H31BENZOXAZIN2YL)2(3NITROPHENYL)1HISOINDOLE13(2H)DIONE
C1=CC(=CC(=C1)(N+)(=O)(O))N2C(=O)C3=C(C2=O)C=C(C=C3)C4=NC5=C(C=CC(=C5)Cl)C(=O)O4
Clc1ccc2c(c1)nc(oc2=O)c1ccc2c(c1)C(=O)N(C2=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC22H10ClN3O6c2312571618(912)2419(3222(16)29)11461517(811)21(28)25(20(15)27)1321314(1013)26(30)31h110H
MFCD01137050
STK075004
ZINC000001209904
ZINC01209904
ZINC1209904
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