Vitas-M small molecule compound
2-(2-chloro-5-nitrophenyl)-6,7-dimethoxy-4H-3,1-benzoxazin-4-one
Catalog ID
STK731743
SMILES COc1cc2nc(oc(=O)c2cc1OC)c1cc(ccc1Cl)[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 C16H11ClN2O6 MW 362.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11ClN2O6/c1-23-13-6-10-12(7-14(13)24-2)18-15(25-16(10)20)9-5-8(19(21)22)3-4-11(9)17/h3-7H,1-2H3InChIKey
CWQZCYGLMWLQFZ-UHFFFAOYSA-NSynonyms
313516-63-12(2CHLORO5NITROPHENYL)67DIMETHOXY31BENZOXAZIN4ONE
2(2chloro5nitrophenyl)67dimethoxy4H31benzoxazin4one
2(2chloro5nitrophenyl)67dimethoxy4Hbenzo(d)(13)oxazin4one
313516631
COC1=C(C=C2C(=C1)C(=O)OC(=N2)C3=C(C=CC(=C3)(N+)(=O)(O))Cl)OC
COc1cc2nc(oc(=O)c2cc1OC)c1cc(ccc1Cl)(N+)(=O)(O)
InChI=1SC16H11ClN2O6c1231361012(714(13)242)1815(2516(10)20)958(19(21)22)3411(9)17h37H12H3
MFCD00989760
ZINC000001306068
ZINC01306068
ZINC1306068
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