Vitas-M small molecule compound

ethyl 3-{[(2-chloro-4-nitrophenyl)carbonyl]amino}-3-(4-methylphenyl)propanoate

Catalog ID
STK773805
SMILES CCOC(=O)CC(c1ccc(cc1)C)NC(=O)c1ccc(cc1Cl)[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 C19H19ClN2O5 MW 390.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClN2O5/c1-3-27-18(23)11-17(13-6-4-12(2)5-7-13)21-19(24)15-9-8-14(22(25)26)10-16(15)20/h4-10,17H,3,11H2,1-2H3,(H,21,24)
InChIKey
GYKFGAQGPVNVEA-UHFFFAOYSA-N
Synonyms

CCOC(=O)CC(C1=CC=C(C=C1)C)NC(=O)C2=C(C=C(C=C2)(N+)(=O)(O))Cl
CCOC(=O)CC(c1ccc(cc1)C)NC(=O)c1ccc(cc1Cl)(N+)(=O)(O)
ethyl3(((2chloro4nitrophenyl)carbonyl)amino)3(4methylphenyl)propanoate
ETHYL3((2CHLORO4NITROBENZOYL)AMINO)3(4METHYLPHENYL)PROPANOATE
InChI=1SC19H19ClN2O5c132718(23)1117(136412(2)5713)2119(24)159814(22(25)26)1016(15)20h41017H311H212H3(H2124)
MFCD03855659
ZINC000004653464
ZINC000004653465

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.