2-azanyl-3-[2-(4-methoxyphenyl)ethylsulfanyl]propanoic acid

Systemtic Name: 2-azanyl-3-[2-(4-methoxyphenyl)ethylsulfanyl]propanoic acid Openeye Name: 2-amino-3-[2-(4-methoxyphenyl)ethylsulfanyl]propanoic acid CAS Name: 2-amino-3-[2-(4-methoxyphenyl)ethylthio]propanoic acid IUPAC Name: 2-amino-3-[2-(4-methoxyphenyl)ethylsulfanyl]propanoic acid Traditional Name: 2-amino-3-[2-(4-methoxyphenyl)ethylthio]propionic acid Formula: C12H17NO3S MolecularWeight: 255.33328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCSCC(C(=O)O)N

Isomeric SMILES

COC1=CC=C(C=C1)CCSCC(C(=O)O)N

InChI

InChI=1S/C12H17NO3S/c1-16-10-4-2-9(3-5-10)6-7-17-8-11(13)12(14)15/h2-5,11H,6-8,13H2,1H3,(H,14,15)