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

Systemtic Name: 1-[4-bromanyl-3-[4-(diphenylmethyl)piperazin-1-yl]quinolin-5-yl]oxypropan-2-ol Openeye Name: 1-[[3-(4-benzhydrylpiperazin-1-yl)-4-bromo-5-quinolyl]oxy]propan-2-ol CAS Name: 1-[[4-bromo-3-[4-(diphenylmethyl)-1-piperazinyl]-5-quinolinyl]oxy]-2-propanol IUPAC Name: 1-[3-(4-benzhydrylpiperazin-1-yl)-4-bromoquinolin-5-yl]oxypropan-2-ol Traditional Name: 1-[[3-(4-benzhydrylpiperazino)-4-bromo-5-quinolyl]oxy]propan-2-ol Formula: C29H30BrN3O2 MolecularWeight: 532.4714

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=CC=CC2=NC=C(C(=C21)Br)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)O

Isomeric SMILES

CC(COC1=CC=CC2=NC=C(C(=C21)Br)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)O

InChI

InChI=1S/C29H30BrN3O2/c1-21(34)20-35-26-14-8-13-24-27(26)28(30)25(19-31-24)32-15-17-33(18-16-32)29(22-9-4-2-5-10-22)23-11-6-3-7-12-23/h2-14,19,21,29,34H,15-18,20H2,1H3