Vitas-M small molecule compound
6,7-dimethoxy-2-(3-nitrophenyl)-4H-3,1-benzoxazin-4-one
Catalog ID
STK005278
SMILES COc1cc2nc(oc(=O)c2cc1OC)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 C16H12N2O6 MW 328.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N2O6/c1-22-13-7-11-12(8-14(13)23-2)17-15(24-16(11)19)9-4-3-5-10(6-9)18(20)21/h3-8H,1-2H3InChIKey
HSFDECLWIMVSIE-UHFFFAOYSA-NSynonyms
331461-74-6331461746
67DIMETHOXY2(3NITROPHENYL)31BENZOXAZIN4ONE
67DIMETHOXY2(3NITROPHENYL)4H31BENZOXAZIN4ONE
67DIMETHOXY2(3NITROPHENYL)BENZO(D)(13)OXAZIN4ONE
67DIMETHOXY2(3NITROPHENYL)BENZO(D)13OXAZIN4ONE
COC1=C(C=C2C(=C1)C(=O)OC(=N2)C3=CC(=CC=C3)(N+)(=O)(O))OC
COc1cc2nc(oc(=O)c2cc1OC)c1cccc(c1)(N+)(=O)(O)
InChI=1SC16H12N2O6c1221371112(814(13)232)1715(2416(11)19)943510(69)18(20)21h38H12H3
MFCD00169716
STK005278
ZINC000000110451
ZINC00110451
ZINC110451
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