Vitas-M small molecule compound
methyl N-[(3-nitrophenyl)carbonyl]valinate
Catalog ID
STK442833
SMILES COC(=O)C(C(C)C)NC(=O)c1cccc(c1)[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 C13H16N2O5 MW 280.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N2O5/c1-8(2)11(13(17)20-3)14-12(16)9-5-4-6-10(7-9)15(18)19/h4-8,11H,1-3H3,(H,14,16)InChIKey
HTXNPHLKZGDNLC-UHFFFAOYSA-NSynonyms
CC(C)C(C(=O)OC)NC(=O)C1=CC(=CC=C1)(N+)(=O)(O)
COC(=O)C(C(C)C)NC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC13H16N2O5c18(2)11(13(17)203)1412(16)954610(79)15(18)19h4811H13H3(H1416)
METHYL3METHYL2((3NITROBENZOYL)AMINO)BUTANOATE
METHYL3METHYL2((3NITROPHENYL)CARBONYLAMINO)BUTANOATE
methylN((3nitrophenyl)carbonyl)valinate
MFCD00813515
ZINC000000299112
ZINC000000299114
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