[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 2-(furan-2-ylcarbonylamino)-3-methyl-butanoate

Systemtic Name: [2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 2-(furan-2-ylcarbonylamino)-3-methyl-butanoate Openeye Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 2-(furan-2-carbonylamino)-3-methyl-butanoate CAS Name: 2-[[2-furanyl(oxo)methyl]amino]-3-methylbutanoic acid [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 2-(furan-2-carbonylamino)-3-methylbutanoate Traditional Name: 2-(2-furoylamino)-3-methyl-butyric acid [2-keto-2-(2,4,5-trimethylphenyl)ethyl] ester Formula: C21H25NO5 MolecularWeight: 371.4269

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)COC(=O)C(C(C)C)NC(=O)C2=CC=CO2)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)COC(=O)C(C(C)C)NC(=O)C2=CC=CO2)C)C

InChI

InChI=1S/C21H25NO5/c1-12(2)19(22-20(24)18-7-6-8-26-18)21(25)27-11-17(23)16-10-14(4)13(3)9-15(16)5/h6-10,12,19H,11H2,1-5H3,(H,22,24)