Vitas-M small molecule compound

2-(2-methylphenyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylic acid

Catalog ID
STK384078
SMILES OC(=O)C1C2C=CC3(C1C(=O)N(C3)c1ccccc1C)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 C16H15NO4 MW 285.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15NO4/c1-9-4-2-3-5-10(9)17-8-16-7-6-11(21-16)12(15(19)20)13(16)14(17)18/h2-7,11-13H,8H2,1H3,(H,19,20)
InChIKey
VYOXIQJGYVCXOY-UHFFFAOYSA-N
Synonyms
436810-98-9
(3aS6R)1oxo2(otolyl)123677ahexahydro3a6epoxyisoindole7carboxylicacid
2(2methylphenyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylicacid
436810989
4OXO3OTOLYL10OXA3AZATRICYCLO(
CC1=CC=CC=C1N2CC34C=CC(O3)C(C4C2=O)C(=O)O
InChI=1SC16H15NO4c19423510(9)178167611(2116)12(15(19)20)13(16)14(17)18h271113H8H21H3(H1920)
MFCD03659905
OC(=O)C1(C@H)2C=C(C@@)3(C1C(=O)N(C3)c1ccccc1C)O2
ZINC000001321211
ZINC000004040689

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Available files

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