2-[1-oxidanyl-4-(phenylsulfonylamino)naphthalen-2-yl]sulfanylpropanoic acid

Systemtic Name: 2-[1-oxidanyl-4-(phenylsulfonylamino)naphthalen-2-yl]sulfanylpropanoic acid Openeye Name: 2-[[4-(benzenesulfonamido)-1-hydroxy-2-naphthyl]sulfanyl]propanoic acid CAS Name: 2-[[4-(benzenesulfonamido)-1-hydroxy-2-naphthalenyl]thio]propanoic acid IUPAC Name: 2-[4-(benzenesulfonamido)-1-hydroxynaphthalen-2-yl]sulfanylpropanoic acid Traditional Name: 2-[[4-(benzenesulfonamido)-1-hydroxy-2-naphthyl]thio]propionic acid Formula: C19H17NO5S2 MolecularWeight: 403.47198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=C(C2=CC=CC=C2C(=C1)NS(=O)(=O)C3=CC=CC=C3)O

Isomeric SMILES

CC(C(=O)O)SC1=C(C2=CC=CC=C2C(=C1)NS(=O)(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C19H17NO5S2/c1-12(19(22)23)26-17-11-16(14-9-5-6-10-15(14)18(17)21)20-27(24,25)13-7-3-2-4-8-13/h2-12,20-21H,1H3,(H,22,23)