1-(4-nitro-2-pyrrolidin-1-ylsulfonyl-phenyl)-2-phenethyl-pyrrolidine

Systemtic Name: 1-(4-nitro-2-pyrrolidin-1-ylsulfonyl-phenyl)-2-phenethyl-pyrrolidine Openeye Name: 1-(4-nitro-2-pyrrolidin-1-ylsulfonyl-phenyl)-2-phenethyl-pyrrolidine CAS Name: 1-[4-nitro-2-(1-pyrrolidinylsulfonyl)phenyl]-2-phenethylpyrrolidine IUPAC Name: 1-(4-nitro-2-pyrrolidin-1-ylsulfonylphenyl)-2-phenethylpyrrolidine Traditional Name: 1-(4-nitro-2-pyrrolidinosulfonyl-phenyl)-2-phenethyl-pyrrolidine Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3CCC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3CCC4=CC=CC=C4

InChI

InChI=1S/C22H27N3O4S/c26-25(27)20-12-13-21(22(17-20)30(28,29)23-14-4-5-15-23)24-16-6-9-19(24)11-10-18-7-2-1-3-8-18/h1-3,7-8,12-13,17,19H,4-6,9-11,14-16H2