Vitas-M small molecule compound

methyl 1-[(3-nitrophenyl)sulfonyl]prolinate

Catalog ID
STK665534
SMILES COC(=O)C1CCCN1S(=O)(=O)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 C12H14N2O6S MW 314.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14N2O6S/c1-20-12(15)11-6-3-7-13(11)21(18,19)10-5-2-4-9(8-10)14(16)17/h2,4-5,8,11H,3,6-7H2,1H3
InChIKey
GEKGMABQPJKCJL-UHFFFAOYSA-N
Synonyms

COC(=O)C1CCCN1S(=O)(=O)c1cccc(c1)(N+)(=O)(O)
COC(=O)C1CCCN1S(=O)(=O)C2=CC=CC(=C2)(N+)(=O)(O)
InChI=1SC12H14N2O6Sc12012(15)1163713(11)21(1819)105249(810)14(16)17h245811H367H21H3
methyl1((3nitrophenyl)sulfonyl)prolinate
methyl1(3nitrophenyl)sulfonylpyrrolidine2carboxylate
MFCD09064697
ZINC000012417553
ZINC000012417556

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.