Vitas-M small molecule compound

3-(2-ammonioethyl)-5-nitro-1H-indole-2-carboxylate

Catalog ID
STK856594
SMILES [NH3+]CCc1c([nH]c2c1cc(cc2)[N+](=O)[O-])C(=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 C11H11N3O4 MW 249.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H11N3O4/c12-4-3-7-8-5-6(14(17)18)1-2-9(8)13-10(7)11(15)16/h1-2,5,13H,3-4,12H2,(H,15,16)
InChIKey
XXZAXZCPUWUTNP-UHFFFAOYSA-N
Synonyms
96735-00-1
(NH3+)CCc1c((nH)c2c1cc(cc2)(N+)(=O)(O))C(=O)(O)
3(2AMINOETHYL)5NITRO1HINDOLE2CARBOXYLIC
3(2AMINOETHYL)5NITRO1HINDOLE2CARBOXYLICACID
3(2AMINOETHYL)5NITROINDOLE2CARBOXYLICACID
3(2ammonioethyl)5nitro1Hindole2carboxylate
3(2AZANIUMYLETHYL)5NITRO1HINDOLE2CARBOXYLATE
96735001
C1=CC2=C(C=C1(N+)(=O)(O))C(=C(N2)C(=O)(O))CC(NH3+)
InChI=1SC11H11N3O4c12437856(14(17)18)129(8)1310(7)11(15)16h12513H3412H2(H1516)
MFCD00440647
ZINC000004294764
ZINC04294764
ZINC4294764

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Available files

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