Vitas-M small molecule compound

2-(4-iodophenyl)-3a,4,7,7a-tetrahydro-1H-spiro[2-aza-4,7-methanoisoindole-8,1'-cyclopropane]-1,3(2H)-dione

Catalog ID
STK279228
SMILES O=C1C2C(C(=O)N1c1ccc(cc1)I)C1C3(C2C=C1)CC3

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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 C17H14INO2 MW 391.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14INO2/c18-9-1-3-10(4-2-9)19-15(20)13-11-5-6-12(14(13)16(19)21)17(11)7-8-17/h1-6,11-14H,7-8H2
InChIKey
SXBUIFRWYXAUGI-UHFFFAOYSA-N
Synonyms

(3aR4R7S7aS)2(4iodophenyl)3a477atetrahydro1Hspiro(47methanoisoindole81cyclopropane)13(2H)dione
2(4IODOPHENYL)3A477ATETRAHYDRO1HSPIRO(2AZA47METHANOISOINDOLE81CYCLOPROPANE)13(2H)DIONE
C1CC12C3C=CC2C4C3C(=O)N(C4=O)C5=CC=C(C=C5)I
InChI=1SC17H14INO2c1891310(429)1915(20)13115612(14(13)16(19)21)17(11)7817h161114H78H2
MFCD01187858
ZINC000101362856
ZINC000101362861

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Available files

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