(2S)-2-[(2-hydroxyphenyl)carbonylamino]-4-methylsulfonyl-butanoate

Systemtic Name: (2S)-2-[(2-hydroxyphenyl)carbonylamino]-4-methylsulfonyl-butanoate Openeye Name: (2S)-2-[(2-hydroxybenzoyl)amino]-4-methylsulfonyl-butanoate CAS Name: (2S)-2-[[(2-hydroxyphenyl)-oxomethyl]amino]-4-methylsulfonylbutanoate IUPAC Name: (2S)-2-[(2-hydroxybenzoyl)amino]-4-methylsulfonylbutanoate Traditional Name: (2S)-4-mesyl-2-(salicyloylamino)butyrate Formula: C12H14NO6S- MolecularWeight: 300.30766

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)[O-])NC(=O)C1=CC=CC=C1O

Isomeric SMILES

CS(=O)(=O)CC[C@@H](C(=O)[O-])NC(=O)C1=CC=CC=C1O

InChI

InChI=1S/C12H15NO6S/c1-20(18,19)7-6-9(12(16)17)13-11(15)8-4-2-3-5-10(8)14/h2-5,9,14H,6-7H2,1H3,(H,13,15)(H,16,17)/p-1/t9-/m0/s1