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

Systemtic Name: 3-[4-(diphenylmethyl)piperazin-1-yl]carbonylbicyclo[3.3.1]nonan-9-one Openeye Name: 3-(4-benzhydrylpiperazine-1-carbonyl)bicyclo[3.3.1]nonan-9-one CAS Name: 3-[[4-(diphenylmethyl)-1-piperazinyl]-oxomethyl]-9-bicyclo[3.3.1]nonanone IUPAC Name: 3-(4-benzhydrylpiperazine-1-carbonyl)bicyclo[3.3.1]nonan-9-one Traditional Name: 3-(4-benzhydrylpiperazine-1-carbonyl)bicyclo[3.3.1]nonan-9-one Formula: C27H32N2O2 MolecularWeight: 416.55518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(CC(C1)C2=O)C(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CC2CC(CC(C1)C2=O)C(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H32N2O2/c30-26-22-12-7-13-23(26)19-24(18-22)27(31)29-16-14-28(15-17-29)25(20-8-3-1-4-9-20)21-10-5-2-6-11-21/h1-6,8-11,22-25H,7,12-19H2