Vitas-M small molecule compound
methyl 3-[(6-methylheptan-2-yl)carbamoyl]-5-nitrobenzoate
Catalog ID
STK069677
SMILES COC(=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)NC(CCCC(C)C)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 C17H24N2O5 MW 336.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H24N2O5/c1-11(2)6-5-7-12(3)18-16(20)13-8-14(17(21)24-4)10-15(9-13)19(22)23/h8-12H,5-7H2,1-4H3,(H,18,20)InChIKey
ASCUTHWCLJOOIG-UHFFFAOYSA-NSynonyms
432498-43-6432498436
CC(C)CCCC(C)NC(=O)C1=CC(=CC(=C1)(N+)(=O)(O))C(=O)OC
COC(=O)c1cc(cc(c1)(N+)(=O)(O))C(=O)NC(CCCC(C)C)C
InChI=1SC17H24N2O5c111(2)65712(3)1816(20)13814(17(21)244)1015(913)19(22)23h812H57H214H3(H1820)
METHYL3((6METHYLHEPTAN2YL)CARBAMOYL)5NITROBENZOATE
METHYL3(6METHYLHEPTAN2YLCARBAMOYL)5NITROBENZOATE
MFCD03143540
STK069677
ZINC000002988770
ZINC000002988771
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