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

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] (2S)-3-methyl-2-[(2-methylphenyl)carbonylamino]butanoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] (2S)-3-methyl-2-[(2-methylbenzoyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[[(2-methylphenyl)-oxomethyl]amino]butanoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] (2S)-3-methyl-2-[(2-methylbenzoyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-(o-toluoylamino)butyric acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C20H30N2O4 MolecularWeight: 362.4632

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30N2O4/c1-6-15(7-2)21-17(23)12-26-20(25)18(13(3)4)22-19(24)16-11-9-8-10-14(16)5/h8-11,13,15,18H,6-7,12H2,1-5H3,(H,21,23)(H,22,24)/t18-/m0/s1