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

Systemtic Name: 1-(2-butylquinolin-5-yl)oxy-3-[4-(diphenylmethyl)piperazin-1-yl]propan-2-ol Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-3-[(2-butyl-5-quinolyl)oxy]propan-2-ol CAS Name: 1-[(2-butyl-5-quinolinyl)oxy]-3-[4-(diphenylmethyl)-1-piperazinyl]-2-propanol IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-3-(2-butylquinolin-5-yl)oxypropan-2-ol Traditional Name: 1-(4-benzhydrylpiperazino)-3-[(2-butyl-5-quinolyl)oxy]propan-2-ol Formula: C33H39N3O2 MolecularWeight: 509.68166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C=C1)C(=CC=C2)OCC(CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)O

Isomeric SMILES

CCCCC1=NC2=C(C=C1)C(=CC=C2)OCC(CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)O

InChI

InChI=1S/C33H39N3O2/c1-2-3-15-28-18-19-30-31(34-28)16-10-17-32(30)38-25-29(37)24-35-20-22-36(23-21-35)33(26-11-6-4-7-12-26)27-13-8-5-9-14-27/h4-14,16-19,29,33,37H,2-3,15,20-25H2,1H3