Vitas-M small molecule compound
methyl 3-[(2,6-dimethylphenyl)carbamoyl]-5-nitrobenzoate
Catalog ID
STL260717
SMILES COC(=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)Nc1c(C)cccc1C
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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 C17H16N2O5 MW 328.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O5/c1-10-5-4-6-11(2)15(10)18-16(20)12-7-13(17(21)24-3)9-14(8-12)19(22)23/h4-9H,1-3H3,(H,18,20)InChIKey
RLQCIQYMZYDFQX-UHFFFAOYSA-NSynonyms
329931-74-0329931740
CC1=C(C(=CC=C1)C)NC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))C(=O)OC
COC(=O)c1cc(cc(c1)(N+)(=O)(O))C(=O)Nc1c(C)cccc1C
InChI=1SC17H16N2O5c11054611(2)15(10)1816(20)12713(17(21)243)914(812)19(22)23h49H13H3(H1820)
methyl3((26dimethylphenyl)carbamoyl)5nitrobenzoate
METHYL5(N(26DIMETHYLPHENYL)CARBAMOYL)3NITROBENZOATE
MFCD01196892
ZINC000000060814
ZINC00060814
ZINC60814
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