Vitas-M small molecule compound

2-chloro-5-(5-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)benzoic acid

Catalog ID
STK252610
SMILES CC1=CCC2C(C1)C(=O)N(C2=O)c1ccc(c(c1)C(=O)O)Cl

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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 C16H14ClNO4 MW 319.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14ClNO4/c1-8-2-4-10-11(6-8)15(20)18(14(10)19)9-3-5-13(17)12(7-9)16(21)22/h2-3,5,7,10-11H,4,6H2,1H3,(H,21,22)
InChIKey
COPLECYLFKVOII-UHFFFAOYSA-N
Synonyms
519169-83-6
2CHLORO5(5METHYL13DIOXO133A477AHEXAHYDRO2HISOINDOL2YL)BENZOICACID
2chloro5(5methyl13dioxo3a477atetrahydro1Hisoindol2(3H)yl)benzoicacid
2CHLORO5(5METHYL13DIOXO3A477ATETRAHYDROISOINDOL2YL)BENZOICACID
519169836
CC1=CCC2C(C1)C(=O)N(C2=O)C3=CC(=C(C=C3)Cl)C(=O)O
InChI=1SC16H14ClNO4c18241011(68)15(20)18(14(10)19)93513(17)12(79)16(21)22h23571011H46H21H3(H2122)
MFCD03350411
ZINC000004893242
ZINC000101012128

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Available files

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