(2S,3S)-2-methyl-3-(2-phenylethanoylamino)butanoic acid

Systemtic Name: (2S,3S)-2-methyl-3-(2-phenylethanoylamino)butanoic acid Openeye Name: (2S,3S)-2-methyl-3-[(2-phenylacetyl)amino]butanoic acid CAS Name: (2S,3S)-2-methyl-3-[(1-oxo-2-phenylethyl)amino]butanoic acid IUPAC Name: (2S,3S)-2-methyl-3-[(2-phenylacetyl)amino]butanoic acid Traditional Name: (2S,3S)-2-methyl-3-[(2-phenylacetyl)amino]butyric acid Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO3/c1-9(13(16)17)10(2)14-12(15)8-11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3,(H,14,15)(H,16,17)/t9-,10-/m0/s1