Vitas-M small molecule compound

ethyl 4-{[(1E)-3-(4-ethoxyphenyl)-3-oxoprop-1-en-1-yl]amino}benzoate

Catalog ID
STK987123
SMILES CCOc1ccc(cc1)C(=O)/C=C/Nc1ccc(cc1)C(=O)OCC

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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 C20H21NO4 MW 339.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO4/c1-3-24-18-11-7-15(8-12-18)19(22)13-14-21-17-9-5-16(6-10-17)20(23)25-4-2/h5-14,21H,3-4H2,1-2H3/b14-13+
InChIKey
XRSDLMHIGBEXII-BUHFOSPRSA-N
Synonyms

CCOC1=CC=C(C=C1)C(=O)C=CNC2=CC=C(C=C2)C(=O)OCC
CCOc1ccc(cc1)C(=O)C=CNc1ccc(cc1)C(=O)OCC
ethyl4(((1E)3(4ethoxyphenyl)3oxoprop1en1yl)amino)benzoate
ETHYL4(((E)3(4ETHOXYPHENYL)3OXOPROP1ENYL)AMINO)BENZOATE
InChI=1SC20H21NO4c13241811715(81218)19(22)131421179516(61017)20(23)2542h51421H34H212H3b1413+
MFCD18183976
ZINC000006246858
ZINC06246858
ZINC6246858

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Available files

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