Vitas-M small molecule compound
2-(1,3-benzodioxol-5-ylmethyl)-3-methoxy-2,3,4,5,6,7-hexahydro-1H-isoindol-1-one
Catalog ID
STK053349
SMILES COC1N(Cc2ccc3c(c2)OCO3)C(=O)C2=C1CCCC2
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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 C17H19NO4 MW 301.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19NO4/c1-20-17-13-5-3-2-4-12(13)16(19)18(17)9-11-6-7-14-15(8-11)22-10-21-14/h6-8,17H,2-5,9-10H2,1H3InChIKey
RBOSXAXOBCGTNC-UHFFFAOYSA-NSynonyms
732259-15-32(13benzodioxol5ylmethyl)3methoxy234567hexahydro1Hisoindol1one
2(13benzodioxol5ylmethyl)3methoxy4567tetrahydro3Hisoindol1one
732259153
COC1C2=C(CCCC2)C(=O)N1CC3=CC4=C(C=C3)OCO4
COC1N(Cc2ccc3c(c2)OCO3)C(=O)C2=C1CCCC2
InChI=1SC17H19NO4c1201713532412(13)16(19)18(17)911671415(811)22102114h6817H25910H21H3
MFCD03990464
STK053349
ZINC000002522293
ZINC000004499432
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