4-[[3-[(4-chlorophenyl)methylsulfanyl]-4-oxidanyl-naphthalen-1-yl]sulfamoyl]benzoic acid

Systemtic Name: 4-[[3-[(4-chlorophenyl)methylsulfanyl]-4-oxidanyl-naphthalen-1-yl]sulfamoyl]benzoic acid Openeye Name: 4-[[3-[(4-chlorophenyl)methylsulfanyl]-4-hydroxy-1-naphthyl]sulfamoyl]benzoic acid CAS Name: 4-[[3-[(4-chlorophenyl)methylthio]-4-hydroxy-1-naphthalenyl]sulfamoyl]benzoic acid IUPAC Name: 4-[[3-[(4-chlorophenyl)methylsulfanyl]-4-hydroxynaphthalen-1-yl]sulfamoyl]benzoic acid Traditional Name: 4-[[3-[(4-chlorobenzyl)thio]-4-hydroxy-1-naphthyl]sulfamoyl]benzoic acid Formula: C24H18ClNO5S2 MolecularWeight: 499.98642

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=C2O)SCC3=CC=C(C=C3)Cl)NS(=O)(=O)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=C2O)SCC3=CC=C(C=C3)Cl)NS(=O)(=O)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C24H18ClNO5S2/c25-17-9-5-15(6-10-17)14-32-22-13-21(19-3-1-2-4-20(19)23(22)27)26-33(30,31)18-11-7-16(8-12-18)24(28)29/h1-13,26-27H,14H2,(H,28,29)