1-(9H-fluoren-2-yl)-3-[4-(phenylmethyl)piperazin-1-yl]propan-1-one dihydrochloride

Systemtic Name: 1-(9H-fluoren-2-yl)-3-[4-(phenylmethyl)piperazin-1-yl]propan-1-one dihydrochloride Openeye Name: 3-(4-benzylpiperazin-1-yl)-1-(9H-fluoren-2-yl)propan-1-one dihydrochloride CAS Name: 1-(9H-fluoren-2-yl)-3-[4-(phenylmethyl)-1-piperazinyl]-1-propanone dihydrochloride IUPAC Name: 3-(4-benzylpiperazin-1-yl)-1-(9H-fluoren-2-yl)propan-1-one dihydrochloride Traditional Name: 3-(4-benzylpiperazino)-1-(9H-fluoren-2-yl)propan-1-one dihydrochloride Formula: C27H30Cl2N2O MolecularWeight: 469.4459

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)C2=CC3=C(C=C2)C4=CC=CC=C4C3)CC5=CC=CC=C5.Cl.Cl

Isomeric SMILES

C1CN(CCN1CCC(=O)C2=CC3=C(C=C2)C4=CC=CC=C4C3)CC5=CC=CC=C5.Cl.Cl

InChI

InChI=1S/C27H28N2O.2ClH/c30-27(23-10-11-26-24(19-23)18-22-8-4-5-9-25(22)26)12-13-28-14-16-29(17-15-28)20-21-6-2-1-3-7-21;;/h1-11,19H,12-18,20H2;2*1H