Vitas-M small molecule compound
2-[3-chloro-4-(4-methylphenoxy)phenyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK274577
SMILES Cc1ccc(cc1)Oc1ccc(cc1Cl)N1C(=O)C2C(C1=O)CC=CC2
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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 C21H18ClNO3 MW 367.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClNO3/c1-13-6-9-15(10-7-13)26-19-11-8-14(12-18(19)22)23-20(24)16-4-2-3-5-17(16)21(23)25/h2-3,6-12,16-17H,4-5H2,1H3InChIKey
TZFHBGLWXOGWNA-UHFFFAOYSA-NSynonyms
(3AR7AS)2(3CHLORO4(4METHYLPHENOXY)PHENYL)3A477ATETRAHYDRO1HISOINDOLE13(2H)DIONE
(3AS7AS)2(3CHLORO4(4METHYLPHENOXY)PHENYL)3A477ATETRAHYDRO1HISOINDOLE13(2H)DIONE
2(3chloro4(4methylphenoxy)phenyl)3a477atetrahydro1Hisoindole13(2H)dione
2(3CHLORO4(4METHYLPHENOXY)PHENYL)3A477ATETRAHYDROISOINDOLE13DIONE
CC1=CC=C(C=C1)OC2=C(C=C(C=C2)N3C(=O)C4CC=CCC4C3=O)Cl
InChI=1SC21H18ClNO3c1136915(10713)261911814(1218(19)22)2320(24)16423517(16)21(23)25h236121617H45H21H3
MFCD02822759
ZINC000017987010
ZINC000100744974
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