(2S)-3-methyl-2-[(2-methylphenyl)methylcarbamoylamino]butanoic acid

Systemtic Name: (2S)-3-methyl-2-[(2-methylphenyl)methylcarbamoylamino]butanoic acid Openeye Name: (2S)-3-methyl-2-(o-tolylmethylcarbamoylamino)butanoic acid CAS Name: (2S)-3-methyl-2-[[[(2-methylphenyl)methylamino]-oxomethyl]amino]butanoic acid IUPAC Name: (2S)-3-methyl-2-[(2-methylphenyl)methylcarbamoylamino]butanoic acid Traditional Name: (2S)-3-methyl-2-[(2-methylbenzyl)carbamoylamino]butyric acid Formula: C14H20N2O3 MolecularWeight: 264.3202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)NC(C(C)C)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)N[C@@H](C(C)C)C(=O)O

InChI

InChI=1S/C14H20N2O3/c1-9(2)12(13(17)18)16-14(19)15-8-11-7-5-4-6-10(11)3/h4-7,9,12H,8H2,1-3H3,(H,17,18)(H2,15,16,19)/t12-/m0/s1