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

Systemtic Name: [2-(furan-2-ylmethylcarbamoylamino)-2-oxidanylidene-ethyl] (2S)-2-(furan-2-ylcarbonylamino)-3-methyl-butanoate Openeye Name: [2-(2-furylmethylcarbamoylamino)-2-oxo-ethyl] (2S)-2-(furan-2-carbonylamino)-3-methyl-butanoate CAS Name: (2S)-2-[[2-furanyl(oxo)methyl]amino]-3-methylbutanoic acid [2-[[(2-furanylmethylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] (2S)-2-(furan-2-carbonylamino)-3-methylbutanoate Traditional Name: (2S)-2-(2-furoylamino)-3-methyl-butyric acid [2-(2-furfurylcarbamoylamino)-2-keto-ethyl] ester Formula: C18H21N3O7 MolecularWeight: 391.37524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)NC(=O)NCC1=CC=CO1)NC(=O)C2=CC=CO2

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC(=O)NC(=O)NCC1=CC=CO1)NC(=O)C2=CC=CO2

InChI

InChI=1S/C18H21N3O7/c1-11(2)15(21-16(23)13-6-4-8-27-13)17(24)28-10-14(22)20-18(25)19-9-12-5-3-7-26-12/h3-8,11,15H,9-10H2,1-2H3,(H,21,23)(H2,19,20,22,25)/t15-/m0/s1