[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] (2S)-2-(furan-2-ylcarbonylamino)-3-methyl-butanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] (2S)-2-(furan-2-ylcarbonylamino)-3-methyl-butanoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] (2S)-2-(furan-2-carbonylamino)-3-methyl-butanoate CAS Name: (2S)-2-[[2-furanyl(oxo)methyl]amino]-3-methylbutanoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] (2S)-2-(furan-2-carbonylamino)-3-methylbutanoate Traditional Name: (2S)-2-(2-furoylamino)-3-methyl-butyric acid [2-keto-2-(propargylamino)ethyl] ester Formula: C15H18N2O5 MolecularWeight: 306.31382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)NCC#C)NC(=O)C1=CC=CO1

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC(=O)NCC#C)NC(=O)C1=CC=CO1

InChI

InChI=1S/C15H18N2O5/c1-4-7-16-12(18)9-22-15(20)13(10(2)3)17-14(19)11-6-5-8-21-11/h1,5-6,8,10,13H,7,9H2,2-3H3,(H,16,18)(H,17,19)/t13-/m0/s1