Vitas-M small molecule compound

methyl 2-[(3-methoxy-3-oxopropyl)amino]-5-nitrobenzoate

Catalog ID
STL145764
SMILES COC(=O)c1cc(ccc1NCCC(=O)OC)[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 C12H14N2O6 MW 282.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14N2O6/c1-19-11(15)5-6-13-10-4-3-8(14(17)18)7-9(10)12(16)20-2/h3-4,7,13H,5-6H2,1-2H3
InChIKey
OSIILENXBQHANW-UHFFFAOYSA-N
Synonyms
1223198-05-7
1223198057
COC(=O)c1cc(ccc1NCCC(=O)OC)(N+)(=O)(O)
COC(=O)CCNC1=C(C=C(C=C1)(N+)(=O)(O))C(=O)OC
InChI=1SC12H14N2O6c11911(15)561310438(14(17)18)79(10)12(16)202h34713H56H212H3
methyl2((3methoxy3oxopropyl)amino)5nitrobenzoate
MFCD03424346
ZINC000048354846
ZINC48354846

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Available files

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