Vitas-M small molecule compound

methyl 2-(3-chloro-4-methylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate

Catalog ID
STK247441
SMILES COC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccc(c(c1)Cl)C

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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 C17H12ClNO4 MW 329.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12ClNO4/c1-9-3-5-11(8-14(9)18)19-15(20)12-6-4-10(17(22)23-2)7-13(12)16(19)21/h3-8H,1-2H3
InChIKey
MZMKOXGBPGRXMO-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OC)Cl
InChI=1SC17H12ClNO4c193511(814(9)18)1915(20)126410(17(22)232)713(12)16(19)21h38H12H3
METHYL2(3CHLORO4METHYLPHENYL)13DIOXO23DIHYDRO1HISOINDOLE5CARBOXYLATE
METHYL2(3CHLORO4METHYLPHENYL)13DIOXOISOINDOLE5CARBOXYLATE
METHYL2(3CHLORO4METHYLPHENYL)13DIOXOISOINDOLINE5CARBOXYLATE
MFCD01062788
ZINC000000191370
ZINC00191370
ZINC191370

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Available files

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