Vitas-M small molecule compound
2-[3-(7-chloro-4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]-5-nitro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK295820
SMILES Clc1ccc2c(c1)nc(oc2=O)c1cccc(c1)N1C(=O)c2c(C1=O)cc(cc2)[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/c23-12-4-6-16-18(9-12)24-19(32-22(16)29)11-2-1-3-13(8-11)25-20(27)15-7-5-14(26(30)31)10-17(15)21(25)28/h1-10HInChIKey
RXHWGPUEPVFBNW-UHFFFAOYSA-NSynonyms
2(3(7CHLORO4OXO31BENZOXAZIN2YL)PHENYL)5NITROISOINDOLE13DIONE
2(3(7chloro4oxo4H31benzoxazin2yl)phenyl)5nitro1Hisoindole13(2H)dione
C1=CC(=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)(N+)(=O)(O))C4=NC5=C(C=CC(=C5)Cl)C(=O)O4
Clc1ccc2c(c1)nc(oc2=O)c1cccc(c1)N1C(=O)c2c(C1=O)cc(cc2)(N+)(=O)(O)
InChI=1SC22H10ClN3O6c2312461618(912)2419(3222(16)29)1121313(811)2520(27)157514(26(30)31)1017(15)21(25)28h110H
MFCD01137337
ZINC000002475988
ZINC02475988
ZINC2475988
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