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

Systemtic Name: 3-(2-aminophenyl)sulfanyl-3-(4-methoxyphenyl)-3-oxidanyl-propanoic acid Openeye Name: 3-(2-aminophenyl)sulfanyl-3-hydroxy-3-(4-methoxyphenyl)propanoic acid CAS Name: 3-[(2-aminophenyl)thio]-3-hydroxy-3-(4-methoxyphenyl)propanoic acid IUPAC Name: 3-(2-aminophenyl)sulfanyl-3-hydroxy-3-(4-methoxyphenyl)propanoic acid Traditional Name: 3-[(2-aminophenyl)thio]-3-hydroxy-3-(4-methoxyphenyl)propionic acid Formula: C16H17NO4S MolecularWeight: 319.37548

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CC(=O)O)(O)SC2=CC=CC=C2N

Isomeric SMILES

COC1=CC=C(C=C1)C(CC(=O)O)(O)SC2=CC=CC=C2N

InChI

InChI=1S/C16H17NO4S/c1-21-12-8-6-11(7-9-12)16(20,10-15(18)19)22-14-5-3-2-4-13(14)17/h2-9,20H,10,17H2,1H3,(H,18,19)