(2S)-2-azanyl-6-[(4-methoxyphenyl)methylsulfanyl]hexanoic acid

Systemtic Name: (2S)-2-azanyl-6-[(4-methoxyphenyl)methylsulfanyl]hexanoic acid Openeye Name: (2S)-2-amino-6-[(4-methoxyphenyl)methylsulfanyl]hexanoic acid CAS Name: (2S)-2-amino-6-[(4-methoxyphenyl)methylthio]hexanoic acid IUPAC Name: (2S)-2-amino-6-[(4-methoxyphenyl)methylsulfanyl]hexanoic acid Traditional Name: (2S)-2-amino-6-(p-anisylthio)hexanoic acid Formula: C14H21NO3S MolecularWeight: 283.38644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1=CC=C(C=C1)CSCCCC[C@@H](C(=O)O)N

InChI

InChI=1S/C14H21NO3S/c1-18-12-7-5-11(6-8-12)10-19-9-3-2-4-13(15)14(16)17/h5-8,13H,2-4,9-10,15H2,1H3,(H,16,17)/t13-/m0/s1