Vitas-M small molecule compound
4-(3-methylpiperidin-1-yl)-3,5-dinitrobenzoic acid
Catalog ID
STL503478
SMILES CC1CCCN(C1)c1c(cc(cc1[N+](=O)[O-])C(=O)O)[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 C13H15N3O6 MW 309.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15N3O6/c1-8-3-2-4-14(7-8)12-10(15(19)20)5-9(13(17)18)6-11(12)16(21)22/h5-6,8H,2-4,7H2,1H3,(H,17,18)InChIKey
LYGOUTWKSRSRPB-UHFFFAOYSA-NSynonyms
16193726
4(3methylpiperidin1yl)35dinitrobenzoicacid
InChI=1SC13H15N3O6c1832414(78)1210(15(19)20)59(13(17)18)611(12)16(21)22h568H247H21H3(H1718)
MFCD02653137
ZINC000004660148
ZINC000004660153
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