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

Systemtic Name: [2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] (2S)-3-methyl-2-[(3-methylphenyl)carbonylamino]butanoate Openeye Name: [2-(1,1-dimethylpropylamino)-2-oxo-ethyl] (2S)-3-methyl-2-[(3-methylbenzoyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[[(3-methylphenyl)-oxomethyl]amino]butanoic acid [2-(2-methylbutan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylbutan-2-ylamino)-2-oxoethyl] (2S)-3-methyl-2-[(3-methylbenzoyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-(m-toluoylamino)butyric acid [2-(tert-amylamino)-2-keto-ethyl] ester Formula: C20H30N2O4 MolecularWeight: 362.4632

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)COC(=O)C(C(C)C)NC(=O)C1=CC(=CC=C1)C

Isomeric SMILES

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

InChI

InChI=1S/C20H30N2O4/c1-7-20(5,6)22-16(23)12-26-19(25)17(13(2)3)21-18(24)15-10-8-9-14(4)11-15/h8-11,13,17H,7,12H2,1-6H3,(H,21,24)(H,22,23)/t17-/m0/s1