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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=N1)C=CC=C2OCC(C)O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCC1=C(C=C2C(=N1)C=CC=C2OCC(C)O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H35N3O2/c1-3-27-29(21-26-28(32-27)15-10-16-30(26)36-22-23(2)35)33-17-19-34(20-18-33)31(24-11-6-4-7-12-24)25-13-8-5-9-14-25/h4-16,21,23,31,35H,3,17-20,22H2,1-2H3