Vitas-M small molecule compound
methyl 2-(4-methylpiperazin-1-yl)-5-nitrobenzoate
Catalog ID
STL419597
SMILES COC(=O)c1cc(ccc1N1CCN(CC1)C)[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 C13H17N3O4 MW 279.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17N3O4/c1-14-5-7-15(8-6-14)12-4-3-10(16(18)19)9-11(12)13(17)20-2/h3-4,9H,5-8H2,1-2H3InChIKey
YEWNCBNFPSRCKN-UHFFFAOYSA-NSynonyms
735213-47-5735213475
CN1CCN(CC1)C2=C(C=C(C=C2)(N+)(=O)(O))C(=O)OC
COC(=O)c1cc(ccc1N1CCN(CC1)C)(N+)(=O)(O)
InChI=1SC13H17N3O4c1145715(8614)124310(16(18)19)911(12)13(17)202h349H58H212H3
methyl2(4methylpiperazin1yl)5nitrobenzoate
METHYL2(4METHYLPIPERAZINO)5NITROBENZENECARBOXYLATE
METHYLMETHYLPIPERAZINONITROBENZENECARBOXYLATE
MFCD11553067
ZINC000029218679
ZINC29218679
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