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

Systemtic Name: 1-[3-[4-(diphenylmethyl)piperazin-1-yl]-2-ethoxy-quinolin-5-yl]oxypropan-2-ol Openeye Name: 1-[[3-(4-benzhydrylpiperazin-1-yl)-2-ethoxy-5-quinolyl]oxy]propan-2-ol CAS Name: 1-[[3-[4-(diphenylmethyl)-1-piperazinyl]-2-ethoxy-5-quinolinyl]oxy]-2-propanol IUPAC Name: 1-[3-(4-benzhydrylpiperazin-1-yl)-2-ethoxyquinolin-5-yl]oxypropan-2-ol Traditional Name: 1-[[3-(4-benzhydrylpiperazino)-2-ethoxy-5-quinolyl]oxy]propan-2-ol Formula: C31H35N3O3 MolecularWeight: 497.6279

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=N1)C=CC=C2OCC(C)O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC1=C(C=C2C(=N1)C=CC=C2OCC(C)O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H35N3O3/c1-3-36-31-28(21-26-27(32-31)15-10-16-29(26)37-22-23(2)35)33-17-19-34(20-18-33)30(24-11-6-4-7-12-24)25-13-8-5-9-14-25/h4-16,21,23,30,35H,3,17-20,22H2,1-2H3