1-[2-[(4-chlorophenyl)methylsulfanyl]-5-nitro-phenyl]sulfonylpyrrolidine

Systemtic Name: 1-[2-[(4-chlorophenyl)methylsulfanyl]-5-nitro-phenyl]sulfonylpyrrolidine Openeye Name: 1-[2-[(4-chlorophenyl)methylsulfanyl]-5-nitro-phenyl]sulfonylpyrrolidine CAS Name: 1-[2-[(4-chlorophenyl)methylthio]-5-nitrophenyl]sulfonylpyrrolidine IUPAC Name: 1-[2-[(4-chlorophenyl)methylsulfanyl]-5-nitrophenyl]sulfonylpyrrolidine Traditional Name: 1-[2-[(4-chlorobenzyl)thio]-5-nitro-phenyl]sulfonylpyrrolidine Formula: C17H17ClN2O4S2 MolecularWeight: 412.91088

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H17ClN2O4S2/c18-14-5-3-13(4-6-14)12-25-16-8-7-15(20(21)22)11-17(16)26(23,24)19-9-1-2-10-19/h3-8,11H,1-2,9-10,12H2