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

Systemtic Name: (2S,3S)-3-methyl-2-[(2-methylphenyl)carbamoylamino]pentanoate Openeye Name: (2S,3S)-3-methyl-2-(o-tolylcarbamoylamino)pentanoate CAS Name: (2S,3S)-3-methyl-2-[[(2-methylanilino)-oxomethyl]amino]pentanoate IUPAC Name: (2S,3S)-3-methyl-2-[(2-methylphenyl)carbamoylamino]pentanoate Traditional Name: (2S,3S)-3-methyl-2-(o-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=CC=C1C

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)[O-])NC(=O)NC1=CC=CC=C1C

InChI

InChI=1S/C14H20N2O3/c1-4-9(2)12(13(17)18)16-14(19)15-11-8-6-5-7-10(11)3/h5-9,12H,4H2,1-3H3,(H,17,18)(H2,15,16,19)/p-1/t9-,12-/m0/s1