1-ethylsulfonyl-4-(4-nitro-3-pyrrolidin-1-yl-phenyl)piperazine

Systemtic Name: 1-ethylsulfonyl-4-(4-nitro-3-pyrrolidin-1-yl-phenyl)piperazine Openeye Name: 1-ethylsulfonyl-4-(4-nitro-3-pyrrolidin-1-yl-phenyl)piperazine CAS Name: 1-ethylsulfonyl-4-[4-nitro-3-(1-pyrrolidinyl)phenyl]piperazine IUPAC Name: 1-ethylsulfonyl-4-(4-nitro-3-pyrrolidin-1-ylphenyl)piperazine Traditional Name: 1-esyl-4-(4-nitro-3-pyrrolidino-phenyl)piperazine Formula: C16H24N4O4S MolecularWeight: 368.45116

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])N3CCCC3

Isomeric SMILES

CCS(=O)(=O)N1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])N3CCCC3

InChI

InChI=1S/C16H24N4O4S/c1-2-25(23,24)19-11-9-17(10-12-19)14-5-6-15(20(21)22)16(13-14)18-7-3-4-8-18/h5-6,13H,2-4,7-12H2,1H3