Vitas-M small molecule compound
4,5-dimethoxy-2-{[3-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoyl]amino}benzoic acid
Catalog ID
STK081407
SMILES COc1cc(C(=O)O)c(cc1OC)NC(=O)CCN1C(=O)c2c(C1=O)cc(cc2)[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 C20H17N3O9 MW 443.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O9/c1-31-15-8-13(20(27)28)14(9-16(15)32-2)21-17(24)5-6-22-18(25)11-4-3-10(23(29)30)7-12(11)19(22)26/h3-4,7-9H,5-6H2,1-2H3,(H,21,24)(H,27,28)InChIKey
DQMKGMNNEBDSHV-UHFFFAOYSA-NSynonyms
364620-26-8364620268
45DIMETHOXY2((3(5NITRO13DIOXO13DIHYDRO2HISOINDOL2YL)PROPANOYL)AMINO)BENZOICACID
45DIMETHOXY2(3(5NITRO13DIOXOISOINDOL2YL)PROPANOYLAMINO)BENZOICACID
45dimethoxy2(3(5nitro13dioxoisoindolin2yl)propanamido)benzoicacid
COC1=C(C=C(C(=C1)C(=O)O)NC(=O)CCN2C(=O)C3=C(C2=O)C=C(C=C3)(N+)(=O)(O))OC
COc1cc(C(=O)O)c(cc1OC)NC(=O)CCN1C(=O)c2c(C1=O)cc(cc2)(N+)(=O)(O)
InChI=1SC20H17N3O9c13115813(20(27)28)14(916(15)322)2117(24)562218(25)114310(23(29)30)712(11)19(22)26h3479H56H212H3(H2124)(H2728)
MFCD02767114
STK081407
ZINC000002364915
ZINC2364915
Check stock
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Check stock on Vitas-MAvailable files
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