(2S,3S)-2-[(2,5-dimethylphenyl)sulfonylamino]-3-oxidanyl-butanoate

Systemtic Name: (2S,3S)-2-[(2,5-dimethylphenyl)sulfonylamino]-3-oxidanyl-butanoate Openeye Name: (2S,3S)-2-[(2,5-dimethylphenyl)sulfonylamino]-3-hydroxy-butanoate CAS Name: (2S,3S)-2-[(2,5-dimethylphenyl)sulfonylamino]-3-hydroxybutanoate IUPAC Name: (2S,3S)-2-[(2,5-dimethylphenyl)sulfonylamino]-3-hydroxybutanoate Traditional Name: (2S,3S)-2-[(2,5-dimethylphenyl)sulfonylamino]-3-hydroxy-butyrate Formula: C12H16NO5S- MolecularWeight: 286.32414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NC(C(C)O)C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO5S/c1-7-4-5-8(2)10(6-7)19(17,18)13-11(9(3)14)12(15)16/h4-6,9,11,13-14H,1-3H3,(H,15,16)/p-1/t9-,11-/m0/s1