Vitas-M small molecule compound
2-butoxyethyl 2-(4-nitrophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
Catalog ID
STK252532
SMILES CCCCOCCOC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccc(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 C21H20N2O7 MW 412.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O7/c1-2-3-10-29-11-12-30-21(26)14-4-9-17-18(13-14)20(25)22(19(17)24)15-5-7-16(8-6-15)23(27)28/h4-9,13H,2-3,10-12H2,1H3InChIKey
QXAAXRZYHZLSPO-UHFFFAOYSA-NSynonyms
2BUTOXYETHYL2(4NITROPHENYL)13DIOXO23DIHYDRO1HISOINDOLE5CARBOXYLATE
2BUTOXYETHYL2(4NITROPHENYL)13DIOXOBENZO(C)AZOLIDINE5CARBOXYLATE
2BUTOXYETHYL2(4NITROPHENYL)13DIOXOISOINDOLE5CARBOXYLATE
CCCCOCCOC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=C(C=C3)(N+)(=O)(O)
CCCCOCCOC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC21H20N2O7c123102911123021(26)14491718(1314)20(25)22(19(17)24)155716(8615)23(27)28h4913H231012H21H3
MFCD01577345
ZINC000004181960
ZINC04181960
ZINC4181960
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