3-(2-acetamidophenyl)sulfanyl-2-(4-methoxyphenyl)propanoic acid

Systemtic Name: 3-(2-acetamidophenyl)sulfanyl-2-(4-methoxyphenyl)propanoic acid Openeye Name: 3-(2-acetamidophenyl)sulfanyl-2-(4-methoxyphenyl)propanoic acid CAS Name: 3-[(2-acetamidophenyl)thio]-2-(4-methoxyphenyl)propanoic acid IUPAC Name: 3-(2-acetamidophenyl)sulfanyl-2-(4-methoxyphenyl)propanoic acid Traditional Name: 3-[(2-acetamidophenyl)thio]-2-(4-methoxyphenyl)propionic acid Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC=C1SCC(C2=CC=C(C=C2)OC)C(=O)O

Isomeric SMILES

CC(=O)NC1=CC=CC=C1SCC(C2=CC=C(C=C2)OC)C(=O)O

InChI

InChI=1S/C18H19NO4S/c1-12(20)19-16-5-3-4-6-17(16)24-11-15(18(21)22)13-7-9-14(23-2)10-8-13/h3-10,15H,11H2,1-2H3,(H,19,20)(H,21,22)