1-[4-(3,4-dimethylphenyl)sulfanyl-3-nitro-phenyl]sulfonylpyrrolidine

Systemtic Name: 1-[4-(3,4-dimethylphenyl)sulfanyl-3-nitro-phenyl]sulfonylpyrrolidine Openeye Name: 1-[4-(3,4-dimethylphenyl)sulfanyl-3-nitro-phenyl]sulfonylpyrrolidine CAS Name: 1-[4-[(3,4-dimethylphenyl)thio]-3-nitrophenyl]sulfonylpyrrolidine IUPAC Name: 1-[4-(3,4-dimethylphenyl)sulfanyl-3-nitrophenyl]sulfonylpyrrolidine Traditional Name: 1-[4-[(3,4-dimethylphenyl)thio]-3-nitro-phenyl]sulfonylpyrrolidine Formula: C18H20N2O4S2 MolecularWeight: 392.4924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)SC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-])C

InChI

InChI=1S/C18H20N2O4S2/c1-13-5-6-15(11-14(13)2)25-18-8-7-16(12-17(18)20(21)22)26(23,24)19-9-3-4-10-19/h5-8,11-12H,3-4,9-10H2,1-2H3