Vitas-M small molecule compound

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

Catalog ID
STK384668
SMILES O=C(C1C2C=CC3(C1C(=O)N(C3)c1ccc(c(c1)C)Cl)O2)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 C23H20ClNO4 MW 409.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20ClNO4/c1-14-11-16(7-8-17(14)24)25-13-23-10-9-18(29-23)19(20(23)21(25)26)22(27)28-12-15-5-3-2-4-6-15/h2-11,18-20H,12-13H2,1H3
InChIKey
VCGSOIOXLQVRHJ-UHFFFAOYSA-N
Synonyms

benzyl2(4chloro3methylphenyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
CC1=C(C=CC(=C1)N2CC34C=CC(O3)C(C4C2=O)C(=O)OCC5=CC=CC=C5)Cl
InChI=1SC23H20ClNO4c1141116(7817(14)24)25132310918(2923)19(20(23)21(25)26)22(27)2812155324615h2111820H1213H21H3
MFCD05661639
ZINC000004556364
ZINC000102099858

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Available files

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