(2S)-3-methyl-2-[(2,4,6-trimethylphenyl)carbamoylamino]butanoic acid

Systemtic Name: (2S)-3-methyl-2-[(2,4,6-trimethylphenyl)carbamoylamino]butanoic acid Openeye Name: (2S)-3-methyl-2-[(2,4,6-trimethylphenyl)carbamoylamino]butanoic acid CAS Name: (2S)-3-methyl-2-[[oxo-(2,4,6-trimethylanilino)methyl]amino]butanoic acid IUPAC Name: (2S)-3-methyl-2-[(2,4,6-trimethylphenyl)carbamoylamino]butanoic acid Traditional Name: (2S)-2-(mesitylcarbamoylamino)-3-methyl-butyric acid Formula: C15H22N2O3 MolecularWeight: 278.34678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)NC(C(C)C)C(=O)O)C

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O3/c1-8(2)12(14(18)19)16-15(20)17-13-10(4)6-9(3)7-11(13)5/h6-8,12H,1-5H3,(H,18,19)(H2,16,17,20)/t12-/m0/s1