Vitas-M small molecule compound
2-[(E)-2-(3-nitrophenyl)ethenyl]-4-oxo-4H-3,1-benzoxazin-6-yl acetate
Catalog ID
STK223299
SMILES CC(=O)Oc1ccc2c(c1)c(=O)oc(n2)/C=C/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 C18H12N2O6 MW 352.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12N2O6/c1-11(21)25-14-6-7-16-15(10-14)18(22)26-17(19-16)8-5-12-3-2-4-13(9-12)20(23)24/h2-10H,1H3/b8-5+InChIKey
RWVCGTIROMAYAD-VMPITWQZSA-NSynonyms
667403-99-8(2((E)2(3NITROPHENYL)ETHENYL)4OXO31BENZOXAZIN6YL)ACETATE
(E)2(3nitrostyryl)4oxo4Hbenzo(d)(13)oxazin6ylacetate
2((E)2(3nitrophenyl)ethenyl)4oxo4H31benzoxazin6ylacetate
667403998
CC(=O)OC1=CC2=C(C=C1)N=C(OC2=O)C=CC3=CC(=CC=C3)(N+)(=O)(O)
CC(=O)Oc1ccc2c(c1)c(=O)oc(n2)C=Cc1cccc(c1)(N+)(=O)(O)
InChI=1SC18H12N2O6c111(21)2514671615(1014)18(22)2617(1916)851232413(912)20(23)24h210H1H3b85+
MFCD01974984
ZINC000004270107
ZINC04270107
ZINC4270107
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