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

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 2-(furan-2-ylcarbonylamino)-3-methyl-butanoate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 2-(furan-2-carbonylamino)-3-methyl-butanoate CAS Name: 2-[[2-furanyl(oxo)methyl]amino]-3-methylbutanoic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 2-(furan-2-carbonylamino)-3-methylbutanoate Traditional Name: 2-(2-furoylamino)-3-methyl-butyric acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C15H19N3O5 MolecularWeight: 321.32846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)NCCC#N)NC(=O)C1=CC=CO1

Isomeric SMILES

CC(C)C(C(=O)OCC(=O)NCCC#N)NC(=O)C1=CC=CO1

InChI

InChI=1S/C15H19N3O5/c1-10(2)13(18-14(20)11-5-3-8-22-11)15(21)23-9-12(19)17-7-4-6-16/h3,5,8,10,13H,4,7,9H2,1-2H3,(H,17,19)(H,18,20)