Vitas-M small molecule compound
ethyl 3-amino-7-nitroisoquinoline-4-carboxylate
Catalog ID
STK691402
SMILES CCOC(=O)c1c(N)ncc2c1ccc(c2)[N+](=O)[O-]
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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 C12H11N3O4 MW 261.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11N3O4/c1-2-19-12(16)10-9-4-3-8(15(17)18)5-7(9)6-14-11(10)13/h3-6H,2H2,1H3,(H2,13,14)InChIKey
RTPWEJKPYMSLFA-UHFFFAOYSA-NSynonyms
851266-02-9851266029
CCOC(=O)C1=C2C=CC(=CC2=CN=C1N)(N+)(=O)(O)
CCOC(=O)c1c(N)ncc2c1ccc(c2)(N+)(=O)(O)
ethyl3amino7nitroisoquinoline4carboxylate
InChI=1SC12H11N3O4c121912(16)109438(15(17)18)57(9)61411(10)13h36H2H21H3(H21314)
MFCD09064413
ZINC000012410661
ZINC12410661
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