1-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)-4-pyridin-2-yl-piperazine

Systemtic Name: 1-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)-4-pyridin-2-yl-piperazine Openeye Name: 1-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)-4-(2-pyridyl)piperazine CAS Name: 1-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenyl]-4-(2-pyridinyl)piperazine IUPAC Name: 1-(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)-4-pyridin-2-ylpiperazine Traditional Name: 1-(2-nitro-4-pyrrolidinosulfonyl-phenyl)-4-(2-pyridyl)piperazine Formula: C19H23N5O4S MolecularWeight: 417.48202

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)N3CCN(CC3)C4=CC=CC=N4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)N3CCN(CC3)C4=CC=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C19H23N5O4S/c25-24(26)18-15-16(29(27,28)23-9-3-4-10-23)6-7-17(18)21-11-13-22(14-12-21)19-5-1-2-8-20-19/h1-2,5-8,15H,3-4,9-14H2