3-oxidanyl-2-[2-(phenylmethylsulfanyl)ethylamino]propanoic acid

Systemtic Name: 3-oxidanyl-2-[2-(phenylmethylsulfanyl)ethylamino]propanoic acid Openeye Name: 2-(2-benzylsulfanylethylamino)-3-hydroxy-propanoic acid CAS Name: 3-hydroxy-2-[2-(phenylmethylthio)ethylamino]propanoic acid IUPAC Name: 2-(2-benzylsulfanylethylamino)-3-hydroxypropanoic acid Traditional Name: 2-[2-(benzylthio)ethylamino]-3-hydroxy-propionic acid Formula: C12H17NO3S MolecularWeight: 255.33328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCNC(CO)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CSCCNC(CO)C(=O)O

InChI

InChI=1S/C12H17NO3S/c14-8-11(12(15)16)13-6-7-17-9-10-4-2-1-3-5-10/h1-5,11,13-14H,6-9H2,(H,15,16)