(2S,3S)-2-[(3,5-dimethylphenyl)carbonylamino]-3-oxidanyl-butanoic acid

Systemtic Name: (2S,3S)-2-[(3,5-dimethylphenyl)carbonylamino]-3-oxidanyl-butanoic acid Openeye Name: (2S,3S)-2-[(3,5-dimethylbenzoyl)amino]-3-hydroxy-butanoic acid CAS Name: (2S,3S)-2-[[(3,5-dimethylphenyl)-oxomethyl]amino]-3-hydroxybutanoic acid IUPAC Name: (2S,3S)-2-[(3,5-dimethylbenzoyl)amino]-3-hydroxybutanoic acid Traditional Name: (2S,3S)-2-[(3,5-dimethylbenzoyl)amino]-3-hydroxy-butyric acid Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO4/c1-7-4-8(2)6-10(5-7)12(16)14-11(9(3)15)13(17)18/h4-6,9,11,15H,1-3H3,(H,14,16)(H,17,18)/t9-,11-/m0/s1