5-azanyl-3-[(4-methoxyphenyl)methylsulfanyl]pentanoic acid

Systemtic Name: 5-azanyl-3-[(4-methoxyphenyl)methylsulfanyl]pentanoic acid Openeye Name: 5-amino-3-[(4-methoxyphenyl)methylsulfanyl]pentanoic acid CAS Name: 5-amino-3-[(4-methoxyphenyl)methylthio]pentanoic acid IUPAC Name: 5-amino-3-[(4-methoxyphenyl)methylsulfanyl]pentanoic acid Traditional Name: 5-amino-3-(p-anisylthio)valeric acid Formula: C13H19NO3S MolecularWeight: 269.35986

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSC(CCN)CC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)CSC(CCN)CC(=O)O

InChI

InChI=1S/C13H19NO3S/c1-17-11-4-2-10(3-5-11)9-18-12(6-7-14)8-13(15)16/h2-5,12H,6-9,14H2,1H3,(H,15,16)