1-[4-[(4-chlorophenyl)methylsulfanyl]-3-nitro-phenyl]sulfonylpyrrolidine

Systemtic Name: 1-[4-[(4-chlorophenyl)methylsulfanyl]-3-nitro-phenyl]sulfonylpyrrolidine Openeye Name: 1-[4-[(4-chlorophenyl)methylsulfanyl]-3-nitro-phenyl]sulfonylpyrrolidine CAS Name: 1-[4-[(4-chlorophenyl)methylthio]-3-nitrophenyl]sulfonylpyrrolidine IUPAC Name: 1-[4-[(4-chlorophenyl)methylsulfanyl]-3-nitrophenyl]sulfonylpyrrolidine Traditional Name: 1-[4-[(4-chlorobenzyl)thio]-3-nitro-phenyl]sulfonylpyrrolidine Formula: C17H17ClN2O4S2 MolecularWeight: 412.91088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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