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

Systemtic Name: 2-(2-acetamidophenyl)sulfanyl-3-(4-methoxyphenyl)-2-oxidanyl-propanoic acid Openeye Name: 2-(2-acetamidophenyl)sulfanyl-2-hydroxy-3-(4-methoxyphenyl)propanoic acid CAS Name: 2-[(2-acetamidophenyl)thio]-2-hydroxy-3-(4-methoxyphenyl)propanoic acid IUPAC Name: 2-(2-acetamidophenyl)sulfanyl-2-hydroxy-3-(4-methoxyphenyl)propanoic acid Traditional Name: 2-[(2-acetamidophenyl)thio]-2-hydroxy-3-(4-methoxyphenyl)propionic acid Formula: C18H19NO5S MolecularWeight: 361.41216

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC=C1SC(CC2=CC=C(C=C2)OC)(C(=O)O)O

Isomeric SMILES

CC(=O)NC1=CC=CC=C1SC(CC2=CC=C(C=C2)OC)(C(=O)O)O

InChI

InChI=1S/C18H19NO5S/c1-12(20)19-15-5-3-4-6-16(15)25-18(23,17(21)22)11-13-7-9-14(24-2)10-8-13/h3-10,23H,11H2,1-2H3,(H,19,20)(H,21,22)