(2S,3S)-3-methyl-2-[(4-methylphenyl)carbamoylamino]pentanoate

Systemtic Name: (2S,3S)-3-methyl-2-[(4-methylphenyl)carbamoylamino]pentanoate Openeye Name: (2S,3S)-3-methyl-2-(p-tolylcarbamoylamino)pentanoate CAS Name: (2S,3S)-3-methyl-2-[[(4-methylanilino)-oxomethyl]amino]pentanoate IUPAC Name: (2S,3S)-3-methyl-2-[(4-methylphenyl)carbamoylamino]pentanoate Traditional Name: (2S,3S)-3-methyl-2-(p-tolylcarbamoylamino)valerate Formula: C14H19N2O3- MolecularWeight: 263.31226

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NC(=O)NC1=CC=C(C=C1)C

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)[O-])NC(=O)NC1=CC=C(C=C1)C

InChI

InChI=1S/C14H20N2O3/c1-4-10(3)12(13(17)18)16-14(19)15-11-7-5-9(2)6-8-11/h5-8,10,12H,4H2,1-3H3,(H,17,18)(H2,15,16,19)/p-1/t10-,12-/m0/s1