(2S)-2-[(3,4-dimethylphenyl)carbamoylamino]propanoate

Systemtic Name: (2S)-2-[(3,4-dimethylphenyl)carbamoylamino]propanoate Openeye Name: (2S)-2-[(3,4-dimethylphenyl)carbamoylamino]propanoate CAS Name: (2S)-2-[[(3,4-dimethylanilino)-oxomethyl]amino]propanoate IUPAC Name: (2S)-2-[(3,4-dimethylphenyl)carbamoylamino]propanoate Traditional Name: (2S)-2-[(3,4-dimethylphenyl)carbamoylamino]propionate Formula: C12H15N2O3- MolecularWeight: 235.2591

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O3/c1-7-4-5-10(6-8(7)2)14-12(17)13-9(3)11(15)16/h4-6,9H,1-3H3,(H,15,16)(H2,13,14,17)/p-1/t9-/m0/s1