Vitas-M small molecule compound
4-benzylphenyl 4-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)benzoate
Catalog ID
STK286495
SMILES O=C(c1ccc(cc1)N1C(=O)C2C(C1=O)C1CC2CC1)Oc1ccc(cc1)Cc1ccccc1
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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 C29H25NO4 MW 451.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25NO4/c31-27-25-21-8-9-22(17-21)26(25)28(32)30(27)23-12-10-20(11-13-23)29(33)34-24-14-6-19(7-15-24)16-18-4-2-1-3-5-18/h1-7,10-15,21-22,25-26H,8-9,16-17H2InChIKey
FRDASDLNKPUBAA-UHFFFAOYSA-NSynonyms
4benzylphenyl4(13dioxooctahydro2H47methanoisoindol2yl)benzoate
C1CC2CC1C3C2C(=O)N(C3=O)C4=CC=C(C=C4)C(=O)OC5=CC=C(C=C5)CC6=CC=CC=C6
InChI=1SC29H25NO4c312725218922(1721)26(25)28(32)30(27)23121020(111323)29(33)342414619(71524)16184213518h17101521222526H891617H2
MFCD03577255
ZINC000102518778
ZINC000102646887
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