(2S,3S)-2-[(4-methyl-3-oxidanyl-phenyl)carbonylamino]-3-oxidanyl-butanoic acid

Systemtic Name: (2S,3S)-2-[(4-methyl-3-oxidanyl-phenyl)carbonylamino]-3-oxidanyl-butanoic acid Openeye Name: (2S,3S)-3-hydroxy-2-[(3-hydroxy-4-methyl-benzoyl)amino]butanoic acid CAS Name: (2S,3S)-3-hydroxy-2-[[(3-hydroxy-4-methylphenyl)-oxomethyl]amino]butanoic acid IUPAC Name: (2S,3S)-3-hydroxy-2-[(3-hydroxy-4-methylbenzoyl)amino]butanoic acid Traditional Name: (2S,3S)-3-hydroxy-2-[(3-hydroxy-4-methyl-benzoyl)amino]butyric acid Formula: C12H15NO5 MolecularWeight: 253.2512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO5/c1-6-3-4-8(5-9(6)15)11(16)13-10(7(2)14)12(17)18/h3-5,7,10,14-15H,1-2H3,(H,13,16)(H,17,18)/t7-,10-/m0/s1