(2S)-2-[(3-hydroxyphenyl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-[(3-hydroxyphenyl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-[(3-hydroxybenzoyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[(3-hydroxyphenyl)-oxomethyl]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-[(3-hydroxybenzoyl)amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[(3-hydroxybenzoyl)amino]-4-(methylthio)butyrate Formula: C12H14NO4S- MolecularWeight: 268.30886

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)[O-])NC(=O)C1=CC(=CC=C1)O

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO4S/c1-18-6-5-10(12(16)17)13-11(15)8-3-2-4-9(14)7-8/h2-4,7,10,14H,5-6H2,1H3,(H,13,15)(H,16,17)/p-1/t10-/m0/s1