3-[4-(phenylsulfonyl)piperazin-1-yl]carbonylbicyclo[3.3.1]nonan-9-one

Systemtic Name: 3-[4-(phenylsulfonyl)piperazin-1-yl]carbonylbicyclo[3.3.1]nonan-9-one Openeye Name: 3-[4-(benzenesulfonyl)piperazine-1-carbonyl]bicyclo[3.3.1]nonan-9-one CAS Name: 3-[[4-(benzenesulfonyl)-1-piperazinyl]-oxomethyl]-9-bicyclo[3.3.1]nonanone IUPAC Name: 3-[4-(benzenesulfonyl)piperazine-1-carbonyl]bicyclo[3.3.1]nonan-9-one Traditional Name: 3-(4-besylpiperazine-1-carbonyl)bicyclo[3.3.1]nonan-9-one Formula: C20H26N2O4S MolecularWeight: 390.49644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(CC(C1)C2=O)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CC2CC(CC(C1)C2=O)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H26N2O4S/c23-19-15-5-4-6-16(19)14-17(13-15)20(24)21-9-11-22(12-10-21)27(25,26)18-7-2-1-3-8-18/h1-3,7-8,15-17H,4-6,9-14H2