2-[4-(2-azanylethylsulfanyl)phenyl]propanoic acid

Systemtic Name: 2-[4-(2-azanylethylsulfanyl)phenyl]propanoic acid Openeye Name: 2-[4-(2-aminoethylsulfanyl)phenyl]propanoic acid CAS Name: 2-[4-(2-aminoethylthio)phenyl]propanoic acid IUPAC Name: 2-[4-(2-aminoethylsulfanyl)phenyl]propanoic acid Traditional Name: 2-[4-(2-aminoethylthio)phenyl]propionic acid Formula: C11H15NO2S MolecularWeight: 225.3073

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)SCCN)C(=O)O

Isomeric SMILES

CC(C1=CC=C(C=C1)SCCN)C(=O)O

InChI

InChI=1S/C11H15NO2S/c1-8(11(13)14)9-2-4-10(5-3-9)15-7-6-12/h2-5,8H,6-7,12H2,1H3,(H,13,14)