(2-chlorophenyl)-[4-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)piperazin-1-yl]methanone

Systemtic Name: (2-chlorophenyl)-[4-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)piperazin-1-yl]methanone Openeye Name: (2-chlorophenyl)-[4-[2-nitro-4-(1-piperidylsulfonyl)phenyl]piperazin-1-yl]methanone CAS Name: (2-chlorophenyl)-[4-[2-nitro-4-(1-piperidinylsulfonyl)phenyl]-1-piperazinyl]methanone IUPAC Name: (2-chlorophenyl)-[4-(2-nitro-4-piperidin-1-ylsulfonylphenyl)piperazin-1-yl]methanone Traditional Name: (2-chlorophenyl)-[4-(2-nitro-4-piperidinosulfonyl-phenyl)piperazino]methanone Formula: C22H25ClN4O5S MolecularWeight: 492.9757

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H25ClN4O5S/c23-19-7-3-2-6-18(19)22(28)25-14-12-24(13-15-25)20-9-8-17(16-21(20)27(29)30)33(31,32)26-10-4-1-5-11-26/h2-3,6-9,16H,1,4-5,10-15H2