Vitas-M small molecule compound

2-(4-nitrophenyl)-2-oxoethyl (2-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetate

Catalog ID
STK208427
SMILES O=C(CN1CC(=O)Oc2c1cccc2)OCC(=O)c1ccc(cc1)[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 C18H14N2O7 MW 370.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N2O7/c21-15(12-5-7-13(8-6-12)20(24)25)11-26-17(22)9-19-10-18(23)27-16-4-2-1-3-14(16)19/h1-8H,9-11H2
InChIKey
BVIJKUDYNOALAV-UHFFFAOYSA-N
Synonyms

(2(4NITROPHENYL)2OXOETHYL)2(2OXO3H14BENZOXAZIN4YL)ACETATE
2(4NITROPHENYL)2OXOETHYL(2OXO23DIHYDRO4H14BENZOXAZIN4YL)ACETATE
C1C(=O)OC2=CC=CC=C2N1CC(=O)OCC(=O)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC18H14N2O7c2115(125713(8612)20(24)25)112617(22)9191018(23)2716421314(16)19h18H911H2
MFCD02018683
O=C(CN1CC(=O)Oc2c1cccc2)OCC(=O)c1ccc(cc1)(N+)(=O)(O)
ZINC000004746801
ZINC04746801
ZINC4746801

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Available files

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