N-[3-[(4-chlorophenyl)methylsulfanyl]-4-oxidanyl-naphthalen-1-yl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[3-[(4-chlorophenyl)methylsulfanyl]-4-oxidanyl-naphthalen-1-yl]-3-nitro-benzenesulfonamide Openeye Name: N-[3-[(4-chlorophenyl)methylsulfanyl]-4-hydroxy-1-naphthyl]-3-nitro-benzenesulfonamide CAS Name: N-[3-[(4-chlorophenyl)methylthio]-4-hydroxy-1-naphthalenyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[3-[(4-chlorophenyl)methylsulfanyl]-4-hydroxynaphthalen-1-yl]-3-nitrobenzenesulfonamide Traditional Name: N-[3-[(4-chlorobenzyl)thio]-4-hydroxy-1-naphthyl]-3-nitro-benzenesulfonamide Formula: C23H17ClN2O5S2 MolecularWeight: 500.97448

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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=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=C2O)SCC3=CC=C(C=C3)Cl)NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H17ClN2O5S2/c24-16-10-8-15(9-11-16)14-32-22-13-21(19-6-1-2-7-20(19)23(22)27)25-33(30,31)18-5-3-4-17(12-18)26(28)29/h1-13,25,27H,14H2