Vitas-M small molecule compound
N-(heptan-2-yl)-3-methyl-4-nitrobenzamide
Catalog ID
STK375365
SMILES CCCCCC(NC(=O)c1ccc(c(c1)C)[N+](=O)[O-])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 C15H22N2O3 MW 278.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H22N2O3/c1-4-5-6-7-12(3)16-15(18)13-8-9-14(17(19)20)11(2)10-13/h8-10,12H,4-7H2,1-3H3,(H,16,18)InChIKey
DUBMQFMXSSJZJT-UHFFFAOYSA-NSynonyms
CCCCCC(C)NC(=O)C1=CC(=C(C=C1)(N+)(=O)(O))C
CCCCCC(NC(=O)c1ccc(c(c1)C)(N+)(=O)(O))C
InChI=1SC15H22N2O3c1456712(3)1615(18)138914(17(19)20)11(2)1013h81012H47H213H3(H1618)
MFCD01338110
N(heptan2yl)3methyl4nitrobenzamide
N(METHYLHEXYL)(3METHYL4NITROPHENYL)CARBOXAMIDE
NHEPTAN2YL3METHYL4NITROBENZAMIDE
ZINC000002736563
ZINC000002736564
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