3-(8-azanylnaphthalen-1-yl)sulfanyl-3-(4-methoxyphenyl)-2-oxidanyl-propanoic acid

Systemtic Name: 3-(8-azanylnaphthalen-1-yl)sulfanyl-3-(4-methoxyphenyl)-2-oxidanyl-propanoic acid Openeye Name: 3-[(8-amino-1-naphthyl)sulfanyl]-2-hydroxy-3-(4-methoxyphenyl)propanoic acid CAS Name: 3-[(8-amino-1-naphthalenyl)thio]-2-hydroxy-3-(4-methoxyphenyl)propanoic acid IUPAC Name: 3-(8-aminonaphthalen-1-yl)sulfanyl-2-hydroxy-3-(4-methoxyphenyl)propanoic acid Traditional Name: 3-[(8-amino-1-naphthyl)thio]-2-hydroxy-3-(4-methoxyphenyl)propionic acid Formula: C20H19NO4S MolecularWeight: 369.43416

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C(C(=O)O)O)SC2=CC=CC3=C2C(=CC=C3)N

Isomeric SMILES

COC1=CC=C(C=C1)C(C(C(=O)O)O)SC2=CC=CC3=C2C(=CC=C3)N

InChI

InChI=1S/C20H19NO4S/c1-25-14-10-8-13(9-11-14)19(18(22)20(23)24)26-16-7-3-5-12-4-2-6-15(21)17(12)16/h2-11,18-19,22H,21H2,1H3,(H,23,24)