(2S)-2-[(3-methylphenyl)methylcarbamoylamino]propanoate

Systemtic Name: (2S)-2-[(3-methylphenyl)methylcarbamoylamino]propanoate Openeye Name: (2S)-2-(m-tolylmethylcarbamoylamino)propanoate CAS Name: (2S)-2-[[[(3-methylphenyl)methylamino]-oxomethyl]amino]propanoate IUPAC Name: (2S)-2-[(3-methylphenyl)methylcarbamoylamino]propanoate Traditional Name: (2S)-2-[(3-methylbenzyl)carbamoylamino]propionate Formula: C12H15N2O3- MolecularWeight: 235.2591

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC(=O)NC(C)C(=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)CNC(=O)N[C@@H](C)C(=O)[O-]

InChI

InChI=1S/C12H16N2O3/c1-8-4-3-5-10(6-8)7-13-12(17)14-9(2)11(15)16/h3-6,9H,7H2,1-2H3,(H,15,16)(H2,13,14,17)/p-1/t9-/m0/s1