Vitas-M small molecule compound
3-(5-chloro-2-hydroxyphenyl)-5-(4-methylphenyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
Catalog ID
STL193015
SMILES OC(=O)C1NC(C2C1C(=O)N(C2=O)c1ccc(cc1)C)c1cc(Cl)ccc1O
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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 C20H17ClN2O5 MW 400.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN2O5/c1-9-2-5-11(6-3-9)23-18(25)14-15(19(23)26)17(20(27)28)22-16(14)12-8-10(21)4-7-13(12)24/h2-8,14-17,22,24H,1H3,(H,27,28)InChIKey
RMBALRUXMNXDFA-UHFFFAOYSA-NSynonyms
1(5chloro2hydroxyphenyl)5(4methylphenyl)46dioxo233a6atetrahydro1Hpyrrolo(34c)pyrrole3carboxylicacid
3(5chloro2hydroxyphenyl)5(4methylphenyl)46dioxooctahydropyrrolo(34c)pyrrole1carboxylicacid
CC1=CC=C(C=C1)N2C(=O)C3C(C2=O)C(NC3C4=C(C=CC(=C4)Cl)O)C(=O)O
InChI=1SC20H17ClN2O5c192511(639)2318(25)1415(19(23)26)17(20(27)28)2216(14)12810(21)4713(12)24h2814172224H1H3(H2728)
MFCD22390842
ZINC000106937960
ZINC000230198733
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