Vitas-M small molecule compound
ethyl 4-{[3-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoyl]amino}benzoate
Catalog ID
STK271361
SMILES CCOC(=O)c1ccc(cc1)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 C20H17N3O7 MW 411.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O7/c1-2-30-20(27)12-3-5-13(6-4-12)21-17(24)9-10-22-18(25)15-8-7-14(23(28)29)11-16(15)19(22)26/h3-8,11H,2,9-10H2,1H3,(H,21,24)InChIKey
WLIBYWZOCYMCHG-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)CCN2C(=O)C3=C(C2=O)C=C(C=C3)(N+)(=O)(O)
CCOC(=O)c1ccc(cc1)NC(=O)CCN1C(=O)c2c(C1=O)cc(cc2)(N+)(=O)(O)
ethyl4((3(5nitro13dioxo13dihydro2Hisoindol2yl)propanoyl)amino)benzoate
ETHYL4(3(5NITRO13DIOXOISOINDOL2YL)PROPANOYLAMINO)BENZOATE
InChI=1SC20H17N3O7c123020(27)123513(6412)2117(24)9102218(25)158714(23(28)29)1116(15)19(22)26h3811H2910H21H3(H2124)
MFCD03899590
ZINC000001124318
ZINC01124318
ZINC1124318
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