Vitas-M small molecule compound
methyl N-[(3,5-dinitrophenyl)carbonyl]valinate
Catalog ID
STK444336
SMILES COC(=O)C(C(C)C)NC(=O)c1cc(cc(c1)[N+](=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 C13H15N3O7 MW 325.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15N3O7/c1-7(2)11(13(18)23-3)14-12(17)8-4-9(15(19)20)6-10(5-8)16(21)22/h4-7,11H,1-3H3,(H,14,17)InChIKey
RHAWIJIMMGELRY-UHFFFAOYSA-NSynonyms
2((35DINITROBENZOYL)AMINO)ISOVALERICACIDMETHYLESTER
2(35DINITROBENZOYLAMINO)3METHYLBUTYRICACIDMETHYLESTER
CC(C)C(C(=O)OC)NC(=O)C1=CC(=CC(=C1)(N+)(=O)(O))(N+)(=O)(O)
COC(=O)C(C(C)C)NC(=O)c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC13H15N3O7c17(2)11(13(18)233)1412(17)849(15(19)20)610(58)16(21)22h4711H13H3(H1417)
METHYL2((35DINITROBENZOYL)AMINO)3METHYLBUTANOATE
METHYL2((35DINITROPHENYL)CARBONYLAMINO)3METHYLBUTANOATE
methylN((35dinitrophenyl)carbonyl)valinate
MFCD00547422
ZINC000003138849
ZINC000003138850
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