1-[4-(diphenylmethyl)piperazin-1-yl]-3-(2-ethylquinolin-5-yl)oxy-propan-2-ol

Systemtic Name: 1-[4-(diphenylmethyl)piperazin-1-yl]-3-(2-ethylquinolin-5-yl)oxy-propan-2-ol Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-3-[(2-ethyl-5-quinolyl)oxy]propan-2-ol CAS Name: 1-[4-(diphenylmethyl)-1-piperazinyl]-3-[(2-ethyl-5-quinolinyl)oxy]-2-propanol IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-3-(2-ethylquinolin-5-yl)oxypropan-2-ol Traditional Name: 1-(4-benzhydrylpiperazino)-3-[(2-ethyl-5-quinolyl)oxy]propan-2-ol Formula: C31H35N3O2 MolecularWeight: 481.6285

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=C1)C(=CC=C2)OCC(CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)O

Isomeric SMILES

CCC1=NC2=C(C=C1)C(=CC=C2)OCC(CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)O

InChI

InChI=1S/C31H35N3O2/c1-2-26-16-17-28-29(32-26)14-9-15-30(28)36-23-27(35)22-33-18-20-34(21-19-33)31(24-10-5-3-6-11-24)25-12-7-4-8-13-25/h3-17,27,31,35H,2,18-23H2,1H3