Vitas-M small molecule compound

2-(3-nitrophenyl)-2-oxoethyl 4-(piperidin-1-ylsulfonyl)benzoate

Catalog ID
STK806627
SMILES O=C(c1ccc(cc1)S(=O)(=O)N1CCCCC1)OCC(=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 C20H20N2O7S MW 432.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O7S/c23-19(16-5-4-6-17(13-16)22(25)26)14-29-20(24)15-7-9-18(10-8-15)30(27,28)21-11-2-1-3-12-21/h4-10,13H,1-3,11-12,14H2
InChIKey
AMEZNJBZYZHSQO-UHFFFAOYSA-N
Synonyms

(2(3NITROPHENYL)2OXOETHYL)4PIPERIDIN1YLSULFONYLBENZOATE
2(3nitrophenyl)2oxoethyl4(piperidin1ylsulfonyl)benzoate
2(3NITROPHENYL)2OXOETHYL4(PIPERIDYLSULFONYL)BENZOATE
4(PIPERIDINE1SULFONYL)BENZOICACID2(3NITROPHENYL)2OXOETHYLESTER
C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC(=O)C3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC20H20N2O7Sc2319(1654617(1316)22(25)26)142920(24)157918(10815)30(2728)21112131221h41013H13111214H2
MFCD01166090
O=C(c1ccc(cc1)S(=O)(=O)N1CCCCC1)OCC(=O)c1cccc(c1)(N+)(=O)(O)
ZINC000000834811
ZINC00834811
ZINC834811

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Available files

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