Vitas-M small molecule compound
methyl 4-{[(4-methylphenyl)sulfonyl]methyl}-5-nitro-2-(prop-2-en-1-yloxy)benzoate
Catalog ID
STL406266
SMILES C=CCOc1cc(CS(=O)(=O)c2ccc(cc2)C)c(cc1C(=O)OC)[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 C19H19NO7S MW 405.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19NO7S/c1-4-9-27-18-10-14(17(20(22)23)11-16(18)19(21)26-3)12-28(24,25)15-7-5-13(2)6-8-15/h4-8,10-11H,1,9,12H2,2-3H3InChIKey
IFZAIVZNVYHBJT-UHFFFAOYSA-NSynonyms
329267-66-5329267665
C=CCOc1cc(CS(=O)(=O)c2ccc(cc2)C)c(cc1C(=O)OC)(N+)(=O)(O)
CC1=CC=C(C=C1)S(=O)(=O)CC2=C(C=C(C(=C2)OCC=C)C(=O)OC)(N+)(=O)(O)
InChI=1SC19H19NO7Sc14927181014(17(20(22)23)1116(18)19(21)263)1228(2425)157513(2)6815h481011H1912H223H3
methyl4(((4methylphenyl)sulfonyl)methyl)5nitro2(prop2en1yloxy)benzoate
METHYL4(((4METHYLPHENYL)SULFONYL)METHYL)5NITRO2PROP2ENYLOXYBENZOATE
METHYL4((4METHYLPHENYL)SULFONYLMETHYL)5NITRO2PROP2ENOXYBENZOATE
MFCD02709664
ZINC000003199845
ZINC03199845
ZINC3199845
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