Vitas-M small molecule compound

ethyl 3-(4-ethoxyphenyl)-3-{[(3-nitrophenyl)carbonyl]amino}propanoate

Catalog ID
STK773370
SMILES CCOC(=O)CC(c1ccc(cc1)OCC)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 C20H22N2O6 MW 386.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O6/c1-3-27-17-10-8-14(9-11-17)18(13-19(23)28-4-2)21-20(24)15-6-5-7-16(12-15)22(25)26/h5-12,18H,3-4,13H2,1-2H3,(H,21,24)
InChIKey
XWFHWHMTGMGJDV-UHFFFAOYSA-N
Synonyms

CCOC(=O)CC(c1ccc(cc1)OCC)NC(=O)c1cccc(c1)(N+)(=O)(O)
CCOC1=CC=C(C=C1)C(CC(=O)OCC)NC(=O)C2=CC(=CC=C2)(N+)(=O)(O)
ethyl3(4ethoxyphenyl)3(((3nitrophenyl)carbonyl)amino)propanoate
ETHYL3(4ETHOXYPHENYL)3((3NITROBENZOYL)AMINO)PROPANOATE
InChI=1SC20H22N2O6c13271710814(91117)18(1319(23)2842)2120(24)1565716(1215)22(25)26h51218H3413H212H3(H2124)
MFCD03821715
ZINC000004653324
ZINC000004653325

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Available files

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