Vitas-M small molecule compound
4-nitrophenyl 3-[(4-nitrophenoxy)sulfonyl]benzoate
Catalog ID
STK676490
SMILES O=C(c1cccc(c1)S(=O)(=O)Oc1ccc(cc1)[N+](=O)[O-])Oc1ccc(cc1)[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 C19H12N2O9S MW 444.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12N2O9S/c22-19(29-16-8-4-14(5-9-16)20(23)24)13-2-1-3-18(12-13)31(27,28)30-17-10-6-15(7-11-17)21(25)26/h1-12HInChIKey
COCNECRQKDKZLF-UHFFFAOYSA-NSynonyms
(4NITROPHENYL)3(4NITROPHENOXY)SULFONYLBENZOATE
3(4NITROPHENOXYSULFONYL)BENZOICACID4NITROPHENYLESTER
4nitrophenyl3((4nitrophenoxy)sulfonyl)benzoate
4NITROPHENYL3((4NITROPHENYL)OXYSULFONYL)BENZOATE
C1=CC(=CC(=C1)S(=O)(=O)OC2=CC=C(C=C2)(N+)(=O)(O))C(=O)OC3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC19H12N2O9Sc2219(29168414(5916)20(23)24)1321318(1213)31(2728)301710615(71117)21(25)26h112H
MFCD00227198
O=C(c1cccc(c1)S(=O)(=O)Oc1ccc(cc1)(N+)(=O)(O))Oc1ccc(cc1)(N+)(=O)(O)
ZINC000002023313
ZINC02023313
ZINC2023313
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