[2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl] 5-(4-ethanoylphenyl)furan-2-carboxylate

Systemtic Name: [2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl] 5-(4-ethanoylphenyl)furan-2-carboxylate Openeye Name: [2-(1,1-diethylprop-2-ynylamino)-2-oxo-ethyl] 5-(4-acetylphenyl)furan-2-carboxylate CAS Name: 5-(4-acetylphenyl)-2-furancarboxylic acid [2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl] 5-(4-acetylphenyl)furan-2-carboxylate Traditional Name: 5-(4-acetylphenyl)furan-2-carboxylic acid [2-(1,1-diethylprop-2-ynylamino)-2-keto-ethyl] ester Formula: C22H23NO5 MolecularWeight: 381.42172

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)COC(=O)C1=CC=C(O1)C2=CC=C(C=C2)C(=O)C

Isomeric SMILES

CCC(CC)(C#C)NC(=O)COC(=O)C1=CC=C(O1)C2=CC=C(C=C2)C(=O)C

InChI

InChI=1S/C22H23NO5/c1-5-22(6-2,7-3)23-20(25)14-27-21(26)19-13-12-18(28-19)17-10-8-16(9-11-17)15(4)24/h1,8-13H,6-7,14H2,2-4H3,(H,23,25)