Vitas-M small molecule compound
methyl 3-nitro-5-{[2-(propan-2-yl)phenyl]carbamoyl}benzoate
Catalog ID
STK023434
SMILES COC(=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)Nc1ccccc1C(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 C18H18N2O5 MW 342.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O5/c1-11(2)15-6-4-5-7-16(15)19-17(21)12-8-13(18(22)25-3)10-14(9-12)20(23)24/h4-11H,1-3H3,(H,19,21)InChIKey
JSJHOOMTZFEJOX-UHFFFAOYSA-NSynonyms
328284-51-1328284511
CC(C)C1=CC=CC=C1NC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))C(=O)OC
COC(=O)c1cc(cc(c1)(N+)(=O)(O))C(=O)Nc1ccccc1C(C)C
InChI=1SC18H18N2O5c111(2)15645716(15)1917(21)12813(18(22)253)1014(912)20(23)24h411H13H3(H1921)
METHYL3NITRO5((2(PROPAN2YL)PHENYL)CARBAMOYL)BENZOATE
METHYL3NITRO5((2PROPAN2YLPHENYL)CARBAMOYL)BENZOATE
METHYL5(N(2(METHYLETHYL)PHENYL)CARBAMOYL)3NITROBENZOATE
MFCD01196917
STK023434
ZINC000000060822
ZINC00060822
ZINC60822
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