Vitas-M small molecule compound

methyl 2-[1,3-dioxo-8-(propan-2-ylidene)-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl]benzoate

Catalog ID
STK258085
SMILES COC(=O)c1ccccc1N1C(=O)C2C(C1=O)C1C(=C(C)C)C2C=C1

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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 C20H19NO4 MW 337.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19NO4/c1-10(2)15-12-8-9-13(15)17-16(12)18(22)21(19(17)23)14-7-5-4-6-11(14)20(24)25-3/h4-9,12-13,16-17H,1-3H3
InChIKey
HUGJYMAWPMFJTR-UHFFFAOYSA-N
Synonyms

CC(=C1C2C=CC1C3C2C(=O)N(C3=O)C4=CC=CC=C4C(=O)OC)C
InChI=1SC20H19NO4c110(2)15128913(15)1716(12)18(22)21(19(17)23)14754611(14)20(24)253h4912131617H13H3
methyl2(13dioxo8(propan2ylidene)133a477ahexahydro2H47methanoisoindol2yl)benzoate
MFCD01802290
ZINC000100186994
ZINC000101090404

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Available files

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