Vitas-M small molecule compound

ethyl 4-{[(4-methoxy-3-nitrophenyl)sulfonyl]amino}benzoate

Catalog ID
STK238418
SMILES CCOC(=O)c1ccc(cc1)NS(=O)(=O)c1ccc(c(c1)[N+](=O)[O-])OC

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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 C16H16N2O7S MW 380.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O7S/c1-3-25-16(19)11-4-6-12(7-5-11)17-26(22,23)13-8-9-15(24-2)14(10-13)18(20)21/h4-10,17H,3H2,1-2H3
InChIKey
HUNQPHOYELSISH-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)OC)(N+)(=O)(O)
CCOC(=O)c1ccc(cc1)NS(=O)(=O)c1ccc(c(c1)(N+)(=O)(O))OC
ethyl4(((4methoxy3nitrophenyl)sulfonyl)amino)benzoate
ETHYL4((4METHOXY3NITROPHENYL)SULFONYLAMINO)BENZOATE
InChI=1SC16H16N2O7Sc132516(19)114612(7511)1726(2223)138915(242)14(1013)18(20)21h41017H3H212H3
MFCD04213486
ZINC000004980366
ZINC04980366
ZINC4980366

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Available files

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