[2-oxidanylidene-2-(propylcarbamoylamino)ethyl] (2S)-3-methyl-2-[(2-methylphenyl)carbonylamino]butanoate

Systemtic Name: [2-oxidanylidene-2-(propylcarbamoylamino)ethyl] (2S)-3-methyl-2-[(2-methylphenyl)carbonylamino]butanoate Openeye Name: [2-oxo-2-(propylcarbamoylamino)ethyl] (2S)-3-methyl-2-[(2-methylbenzoyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[[(2-methylphenyl)-oxomethyl]amino]butanoic acid [2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propylcarbamoylamino)ethyl] (2S)-3-methyl-2-[(2-methylbenzoyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-(o-toluoylamino)butyric acid [2-keto-2-(propylcarbamoylamino)ethyl] ester Formula: C19H27N3O5 MolecularWeight: 377.43478

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)COC(=O)C(C(C)C)NC(=O)C1=CC=CC=C1C

Isomeric SMILES

CCCNC(=O)NC(=O)COC(=O)[C@H](C(C)C)NC(=O)C1=CC=CC=C1C

InChI

InChI=1S/C19H27N3O5/c1-5-10-20-19(26)21-15(23)11-27-18(25)16(12(2)3)22-17(24)14-9-7-6-8-13(14)4/h6-9,12,16H,5,10-11H2,1-4H3,(H,22,24)(H2,20,21,23,26)/t16-/m0/s1