[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] (2S)-3-methyl-2-[(2-methylphenyl)carbonylamino]butanoate

Systemtic Name: [(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] (2S)-3-methyl-2-[(2-methylphenyl)carbonylamino]butanoate Openeye Name: [(1S)-2-(ethylamino)-1-methyl-2-oxo-ethyl] (2S)-3-methyl-2-[(2-methylbenzoyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[[(2-methylphenyl)-oxomethyl]amino]butanoic acid [(2S)-1-(ethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(ethylamino)-1-oxopropan-2-yl] (2S)-3-methyl-2-[(2-methylbenzoyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-(o-toluoylamino)butyric acid [(1S)-2-(ethylamino)-2-keto-1-methyl-ethyl] ester Formula: C18H26N2O4 MolecularWeight: 334.41004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)OC(=O)C(C(C)C)NC(=O)C1=CC=CC=C1C

Isomeric SMILES

CCNC(=O)[C@H](C)OC(=O)[C@H](C(C)C)NC(=O)C1=CC=CC=C1C

InChI

InChI=1S/C18H26N2O4/c1-6-19-16(21)13(5)24-18(23)15(11(2)3)20-17(22)14-10-8-7-9-12(14)4/h7-11,13,15H,6H2,1-5H3,(H,19,21)(H,20,22)/t13-,15-/m0/s1