Vitas-M small molecule compound

2-(4-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione

Catalog ID
STK023093
SMILES O=C1C2C3C=CC(C2C(=O)N1c1ccc(cc1)[N+](=O)[O-])C3

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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 C15H12N2O4 MW 284.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12N2O4/c18-14-12-8-1-2-9(7-8)13(12)15(19)16(14)10-3-5-11(6-4-10)17(20)21/h1-6,8-9,12-13H,7H2
InChIKey
KQEVIRDFQKXDCH-UHFFFAOYSA-N
Synonyms
19077-62-4
19077624
2(4NITROPHENYL)3A477ATETRAHYDRO1H47METHANOISOINDOLE13(2H)DIONE
C1C2C=CC1C3C2C(=O)N(C3=O)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC15H12N2O4c1814128129(78)13(12)15(19)16(14)103511(6410)17(20)21h16891213H7H2
MFCD00418234
O=C1C2C3C=CC(C2C(=O)N1c1ccc(cc1)(N+)(=O)(O))C3
STK023093
ZINC000100321444
ZINC000239128688

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Available files

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