2-[[4-(hydroxymethyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[[4-(hydroxymethyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[[4-(hydroxymethyl)benzoyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[[4-(hydroxymethyl)phenyl]-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[[4-(hydroxymethyl)benzoyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(4-methylolbenzoyl)amino]-4-(methylthio)butyric acid Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)C1=CC=C(C=C1)CO

Isomeric SMILES

CSCCC(C(=O)O)NC(=O)C1=CC=C(C=C1)CO

InChI

InChI=1S/C13H17NO4S/c1-19-7-6-11(13(17)18)14-12(16)10-4-2-9(8-15)3-5-10/h2-5,11,15H,6-8H2,1H3,(H,14,16)(H,17,18)