Vitas-M small molecule compound

2-{[(E)-(2-hydroxy-5-nitrophenyl)methylidene]amino}-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione

Catalog ID
STK280758
SMILES O=C1C2C3CCC(C2C(=O)N1/N=C/c1cc(ccc1O)[N+](=O)[O-])C=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 C17H15N3O5 MW 341.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N3O5/c21-13-6-5-12(20(24)25)7-11(13)8-18-19-16(22)14-9-1-2-10(4-3-9)15(14)17(19)23/h1-2,5-10,14-15,21H,3-4H2/b18-8+
InChIKey
HORONSSAEYOHFJ-QGMBQPNBSA-N
Synonyms

2(((E)(2hydroxy5nitrophenyl)methylidene)amino)3a477atetrahydro1H47ethanoisoindole13(2H)dione
MFCD01202722
O=C1C2C3CCC(C2C(=O)N1N=Cc1cc(ccc1O)(N+)(=O)(O))C=C3
ZINC000100179537
ZINC000229928161

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Available files

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