Vitas-M small molecule compound

2-(4-nitrophenyl)-2-oxoethyl 1H-benzotriazol-1-ylacetate

Catalog ID
STK204892
SMILES O=C(Cn1nnc2c1cccc2)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 C16H12N4O5 MW 340.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N4O5/c21-15(11-5-7-12(8-6-11)20(23)24)10-25-16(22)9-19-14-4-2-1-3-13(14)17-18-19/h1-8H,9-10H2
InChIKey
SXRLXEONSCZADL-UHFFFAOYSA-N
Synonyms
332383-69-4
(2(4NITROPHENYL)2OXOETHYL)2(BENZOTRIAZOL1YL)ACETATE
2(4NITROPHENYL)2OXOETHYL1HBENZOTRIAZOL1YLACETATE
2(4nitrophenyl)2oxoethyl2(1Hbenzo(d)(123)triazol1yl)acetate
332383694
BENZOTRIAZOL1YLACETICACID2(4NITROPHENYL)2OXOETHYLESTER
C1=CC=C2C(=C1)N=NN2CC(=O)OCC(=O)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC16H12N4O5c2115(115712(8611)20(23)24)102516(22)91914421313(14)171819h18H910H2
MFCD02018672
O=C(Cn1nnc2c1cccc2)OCC(=O)c1ccc(cc1)(N+)(=O)(O)
ZINC000000367976
ZINC00367976
ZINC367976

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Available files

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