Vitas-M small molecule compound

3,3-dimethyl-1-[(2-methyl-5-nitrophenyl)sulfonyl]piperidine

Catalog ID
STK271505
SMILES Cc1ccc(cc1S(=O)(=O)N1CCCC(C1)(C)C)[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 C14H20N2O4S MW 312.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H20N2O4S/c1-11-5-6-12(16(17)18)9-13(11)21(19,20)15-8-4-7-14(2,3)10-15/h5-6,9H,4,7-8,10H2,1-3H3
InChIKey
YFXZJCKOAGHGDT-UHFFFAOYSA-N
Synonyms
677012-76-9
33dimethyl1((2methyl5nitrophenyl)sulfonyl)piperidine
33DIMETHYL1(2METHYL5NITROPHENYL)SULFONYLPIPERIDINE
677012769
CC1=C(C=C(C=C1)(N+)(=O)(O))S(=O)(=O)N2CCCC(C2)(C)C
Cc1ccc(cc1S(=O)(=O)N1CCCC(C1)(C)C)(N+)(=O)(O)
InChI=1SC14H20N2O4Sc1115612(16(17)18)913(11)21(1920)1584714(23)1015h569H47810H213H3
MFCD03709611
ZINC000004845316
ZINC04845316
ZINC4845316

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Available files

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