Vitas-M small molecule compound

ethyl 3-{[(2E)-3-(furan-2-yl)prop-2-enoyl]amino}benzoate

Catalog ID
STK412335
SMILES CCOC(=O)c1cccc(c1)NC(=O)/C=C/c1ccco1

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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 C16H15NO4 MW 285.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15NO4/c1-2-20-16(19)12-5-3-6-13(11-12)17-15(18)9-8-14-7-4-10-21-14/h3-11H,2H2,1H3,(H,17,18)/b9-8+
InChIKey
PCZFHAFLPRKDSN-CMDGGOBGSA-N
Synonyms

CCOC(=O)C1=CC(=CC=C1)NC(=O)C=CC2=CC=CO2
CCOC(=O)c1cccc(c1)NC(=O)C=Cc1ccco1
ethyl3(((2E)3(furan2yl)prop2enoyl)amino)benzoate
ETHYL3(((E)3(FURAN2YL)PROP2ENOYL)AMINO)BENZOATE
ETHYL3((2E)3(2FURYL)PROP2ENOYLAMINO)BENZOATE
InChI=1SC16H15NO4c122016(19)1253613(1112)1715(18)981474102114h311H2H21H3(H1718)b98+
MFCD00706906
ZINC000002902839
ZINC02902839
ZINC2902839

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Available files

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