2-azanyl-3-(3-phenoxypropylsulfanyl)propanoic acid

Systemtic Name: 2-azanyl-3-(3-phenoxypropylsulfanyl)propanoic acid Openeye Name: 2-amino-3-(3-phenoxypropylsulfanyl)propanoic acid CAS Name: 2-amino-3-(3-phenoxypropylthio)propanoic acid IUPAC Name: 2-amino-3-(3-phenoxypropylsulfanyl)propanoic acid Traditional Name: 2-amino-3-(3-phenoxypropylthio)propionic acid Formula: C12H17NO3S MolecularWeight: 255.33328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCSCC(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)OCCCSCC(C(=O)O)N

InChI

InChI=1S/C12H17NO3S/c13-11(12(14)15)9-17-8-4-7-16-10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9,13H2,(H,14,15)