(2S)-2-[(3-methylsulfonylphenyl)carbonylamino]propanoic acid

Systemtic Name: (2S)-2-[(3-methylsulfonylphenyl)carbonylamino]propanoic acid Openeye Name: (2S)-2-[(3-methylsulfonylbenzoyl)amino]propanoic acid CAS Name: (2S)-2-[[(3-methylsulfonylphenyl)-oxomethyl]amino]propanoic acid IUPAC Name: (2S)-2-[(3-methylsulfonylbenzoyl)amino]propanoic acid Traditional Name: (2S)-2-[(3-mesylbenzoyl)amino]propionic acid Formula: C11H13NO5S MolecularWeight: 271.28962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO5S/c1-7(11(14)15)12-10(13)8-4-3-5-9(6-8)18(2,16)17/h3-7H,1-2H3,(H,12,13)(H,14,15)/t7-/m0/s1