[2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl] (2S)-2-(furan-2-ylcarbonylamino)propanoate

Systemtic Name: [2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl] (2S)-2-(furan-2-ylcarbonylamino)propanoate Openeye Name: [2-(1,1-diethylprop-2-ynylamino)-2-oxo-ethyl] (2S)-2-(furan-2-carbonylamino)propanoate CAS Name: (2S)-2-[[2-furanyl(oxo)methyl]amino]propanoic acid [2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl] (2S)-2-(furan-2-carbonylamino)propanoate Traditional Name: (2S)-2-(2-furoylamino)propionic acid [2-(1,1-diethylprop-2-ynylamino)-2-keto-ethyl] ester Formula: C17H22N2O5 MolecularWeight: 334.36698

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)COC(=O)C(C)NC(=O)C1=CC=CO1

Isomeric SMILES

CCC(CC)(C#C)NC(=O)COC(=O)[C@H](C)NC(=O)C1=CC=CO1

InChI

InChI=1S/C17H22N2O5/c1-5-17(6-2,7-3)19-14(20)11-24-16(22)12(4)18-15(21)13-9-8-10-23-13/h1,8-10,12H,6-7,11H2,2-4H3,(H,18,21)(H,19,20)/t12-/m0/s1