2-(2,5-dimethoxyphenyl)-1-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)pyrrolidine

Systemtic Name: 2-(2,5-dimethoxyphenyl)-1-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)pyrrolidine Openeye Name: 2-(2,5-dimethoxyphenyl)-1-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)pyrrolidine CAS Name: 2-(2,5-dimethoxyphenyl)-1-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenyl]pyrrolidine IUPAC Name: 2-(2,5-dimethoxyphenyl)-1-(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)pyrrolidine Traditional Name: 2-(2,5-dimethoxyphenyl)-1-(2-nitro-4-pyrrolidinosulfonyl-phenyl)pyrrolidine Formula: C22H27N3O6S MolecularWeight: 461.53128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2CCCN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCC4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2CCCN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C22H27N3O6S/c1-30-16-7-10-22(31-2)18(14-16)19-6-5-13-24(19)20-9-8-17(15-21(20)25(26)27)32(28,29)23-11-3-4-12-23/h7-10,14-15,19H,3-6,11-13H2,1-2H3