1-(3-chlorophenyl)-4-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)piperazine

Systemtic Name: 1-(3-chlorophenyl)-4-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)piperazine Openeye Name: 1-(3-chlorophenyl)-4-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)piperazine CAS Name: 1-(3-chlorophenyl)-4-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenyl]piperazine IUPAC Name: 1-(3-chlorophenyl)-4-(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)piperazine Traditional Name: 1-(3-chlorophenyl)-4-(2-nitro-4-pyrrolidinosulfonyl-phenyl)piperazine Formula: C20H23ClN4O4S MolecularWeight: 450.93902

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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=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C20H23ClN4O4S/c21-16-4-3-5-17(14-16)22-10-12-23(13-11-22)19-7-6-18(15-20(19)25(26)27)30(28,29)24-8-1-2-9-24/h3-7,14-15H,1-2,8-13H2