[4-(4-nitrophenyl)piperazin-1-yl]-(3-piperidin-1-ylsulfonylphenyl)methanone

Systemtic Name: [4-(4-nitrophenyl)piperazin-1-yl]-(3-piperidin-1-ylsulfonylphenyl)methanone Openeye Name: [4-(4-nitrophenyl)piperazin-1-yl]-[3-(1-piperidylsulfonyl)phenyl]methanone CAS Name: [4-(4-nitrophenyl)-1-piperazinyl]-[3-(1-piperidinylsulfonyl)phenyl]methanone IUPAC Name: [4-(4-nitrophenyl)piperazin-1-yl]-(3-piperidin-1-ylsulfonylphenyl)methanone Traditional Name: [4-(4-nitrophenyl)piperazino]-(3-piperidinosulfonylphenyl)methanone Formula: C22H26N4O5S MolecularWeight: 458.53064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4O5S/c27-22(18-5-4-6-21(17-18)32(30,31)25-11-2-1-3-12-25)24-15-13-23(14-16-24)19-7-9-20(10-8-19)26(28)29/h4-10,17H,1-3,11-16H2