Vitas-M small molecule compound

benzyl 2-(4-ethylphenyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate

Catalog ID
STK384125
SMILES CCc1ccc(cc1)N1CC23C(C1=O)C(C(O3)C=C2)C(=O)OCc1ccccc1

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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 C24H23NO4 MW 389.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23NO4/c1-2-16-8-10-18(11-9-16)25-15-24-13-12-19(29-24)20(21(24)22(25)26)23(27)28-14-17-6-4-3-5-7-17/h3-13,19-21H,2,14-15H2,1H3
InChIKey
VXGMJSOECKQZJV-UHFFFAOYSA-N
Synonyms

(3aS6R7aR)benzyl2(4ethylphenyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
benzyl2(4ethylphenyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
CCC1=CC=C(C=C1)N2CC34C=CC(O3)C(C4C2=O)C(=O)OCC5=CC=CC=C5
CCc1ccc(cc1)N1C(C@@)23(C@H)(C1=O)C((C@H)(O3)C=C2)C(=O)OCc1ccccc1
InChI=1SC24H23NO4c121681018(11916)251524131219(2924)20(21(24)22(25)26)23(27)2814176435717h3131921H21415H21H3
MFCD04041459
ZINC000004555077
ZINC000015999195

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Available files

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