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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=CC=C2)OCC(CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)O)C

Isomeric SMILES

CC1=CC(=NC2=C1C(=CC=C2)OCC(CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)O)C

InChI

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