Vitas-M small molecule compound

methyl 2-(diphenylmethyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate

Catalog ID
STK384134
SMILES COC(=O)C1C2C=CC3(C1C(=O)N(C3)C(c1ccccc1)c1ccccc1)O2

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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 C23H21NO4 MW 375.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21NO4/c1-27-22(26)18-17-12-13-23(28-17)14-24(21(25)19(18)23)20(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-13,17-20H,14H2,1H3
InChIKey
AJYDXIPSQULZLA-UHFFFAOYSA-N
Synonyms

(3aS6R7aR)methyl2benzhydryl1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
COC(=O)C1(C@H)2C=C(C@@)3((C@@H)1C(=O)N(C3)C(c1ccccc1)c1ccccc1)O2
COC(=O)C1C2C=CC3(C1C(=O)N(C3)C(C4=CC=CC=C4)C5=CC=CC=C5)O2
InChI=1SC23H21NO4c12722(26)1817121323(2817)1424(21(25)19(18)23)20(158425915)16106371116h2131720H14H21H3
methyl2(diphenylmethyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
MFCD03849253
ZINC000100886082
ZINC000238997499

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.