Vitas-M small molecule compound

N-(1,3-benzodioxol-5-ylmethyl)-3-nitrobenzenesulfonamide

Catalog ID
STK710207
SMILES [O-][N+](=O)c1cccc(c1)S(=O)(=O)NCc1ccc2c(c1)OCO2

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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 C14H12N2O6S MW 336.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12N2O6S/c17-16(18)11-2-1-3-12(7-11)23(19,20)15-8-10-4-5-13-14(6-10)22-9-21-13/h1-7,15H,8-9H2
InChIKey
OBTPFOUBXZXIQB-UHFFFAOYSA-N
Synonyms

(2HBENZO(34D)13DIOXOLAN5YLMETHYL)((3NITROPHENYL)SULFONYL)AMINE
(O)(N+)(=O)c1cccc(c1)S(=O)(=O)NCc1ccc2c(c1)OCO2
C1OC2=C(O1)C=C(C=C2)CNS(=O)(=O)C3=CC=CC(=C3)(N+)(=O)(O)
InChI=1SC14H12N2O6Sc1716(18)1121312(711)23(1920)15810451314(610)2292113h1715H89H2
MFCD00469833
N(13benzodioxol5ylmethyl)3nitrobenzenesulfonamide
ZINC000004459136
ZINC04459136
ZINC4459136

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Available files

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