1-[2-butyl-3-[4-(diphenylmethyl)piperazin-1-yl]quinolin-5-yl]oxypropan-2-ol

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C2C(=N1)C=CC=C2OCC(C)O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCCC1=C(C=C2C(=N1)C=CC=C2OCC(C)O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C33H39N3O2/c1-3-4-16-30-31(23-28-29(34-30)17-11-18-32(28)38-24-25(2)37)35-19-21-36(22-20-35)33(26-12-7-5-8-13-26)27-14-9-6-10-15-27/h5-15,17-18,23,25,33,37H,3-4,16,19-22,24H2,1-2H3