Vitas-M small molecule compound
methyl 5-(4-methylpiperazin-1-yl)-2-nitrobenzoate
Catalog ID
STL190851
SMILES COC(=O)c1cc(ccc1[N+](=O)[O-])N1CCN(CC1)C
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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)10-3-4-12(16(18)19)11(9-10)13(17)20-2/h3-4,9H,5-8H2,1-2H3InChIKey
GGKDLVUWXYEOLC-UHFFFAOYSA-NSynonyms
1390027-56-11390027561
CN1CCN(CC1)C2=CC(=C(C=C2)(N+)(=O)(O))C(=O)OC
COC(=O)c1cc(ccc1(N+)(=O)(O))N1CCN(CC1)C
InChI=1SC13H17N3O4c1145715(8614)103412(16(18)19)11(910)13(17)202h349H58H212H3
methyl5(4methylpiperazin1yl)2nitrobenzoate
MFCD22383851
ZINC000029218694
ZINC29218694
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