Vitas-M small molecule compound
2-(4-methoxy-3-nitrophenyl)-4-oxo-4H-3,1-benzoxazin-7-yl acetate
Catalog ID
STK255660
SMILES COc1ccc(cc1[N+](=O)[O-])c1nc2cc(ccc2c(=O)o1)OC(=O)C
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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 C17H12N2O7 MW 356.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12N2O7/c1-9(20)25-11-4-5-12-13(8-11)18-16(26-17(12)21)10-3-6-15(24-2)14(7-10)19(22)23/h3-8H,1-2H3InChIKey
FWSHOOQOSCTBTH-UHFFFAOYSA-NSynonyms
(2(4METHOXY3NITROPHENYL)4OXO31BENZOXAZIN7YL)ACETATE
2(4methoxy3nitrophenyl)4oxo4H31benzoxazin7ylacetate
CC(=O)OC1=CC2=C(C=C1)C(=O)OC(=N2)C3=CC(=C(C=C3)OC)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))c1nc2cc(ccc2c(=O)o1)OC(=O)C
InChI=1SC17H12N2O7c19(20)2511451213(811)1816(2617(12)21)103615(242)14(710)19(22)23h38H12H3
MFCD03898777
ZINC000002850453
ZINC02850453
ZINC2850453
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