1-[2-[3,5-bis(chloranyl)phenoxy]-5-nitro-phenyl]sulfonyl-3-pyrrolidin-1-yl-pyrrolidine

Systemtic Name: 1-[2-[3,5-bis(chloranyl)phenoxy]-5-nitro-phenyl]sulfonyl-3-pyrrolidin-1-yl-pyrrolidine Openeye Name: 1-[2-(3,5-dichlorophenoxy)-5-nitro-phenyl]sulfonyl-3-pyrrolidin-1-yl-pyrrolidine CAS Name: 1-[2-(3,5-dichlorophenoxy)-5-nitrophenyl]sulfonyl-3-(1-pyrrolidinyl)pyrrolidine IUPAC Name: 1-[2-(3,5-dichlorophenoxy)-5-nitrophenyl]sulfonyl-3-pyrrolidin-1-ylpyrrolidine Traditional Name: 1-[2-(3,5-dichlorophenoxy)-5-nitro-phenyl]sulfonyl-3-pyrrolidino-pyrrolidine Formula: C20H21Cl2N3O5S MolecularWeight: 486.36884

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2CCN(C2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])OC4=CC(=CC(=C4)Cl)Cl

Isomeric SMILES

C1CCN(C1)C2CCN(C2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])OC4=CC(=CC(=C4)Cl)Cl

InChI

InChI=1S/C20H21Cl2N3O5S/c21-14-9-15(22)11-18(10-14)30-19-4-3-16(25(26)27)12-20(19)31(28,29)24-8-5-17(13-24)23-6-1-2-7-23/h3-4,9-12,17H,1-2,5-8,13H2