[6-(6-bromanyl-2-methoxy-quinolin-3-yl)-5-oxidanyl-5,6-diphenyl-hexyl]-trimethyl-azanium

Systemtic Name: [6-(6-bromanyl-2-methoxy-quinolin-3-yl)-5-oxidanyl-5,6-diphenyl-hexyl]-trimethyl-azanium Openeye Name: [6-(6-bromo-2-methoxy-3-quinolyl)-5-hydroxy-5,6-diphenyl-hexyl]-trimethyl-ammonium CAS Name: [6-(6-bromo-2-methoxy-3-quinolinyl)-5-hydroxy-5,6-diphenylhexyl]-trimethylammonium IUPAC Name: [6-(6-bromo-2-methoxyquinolin-3-yl)-5-hydroxy-5,6-diphenylhexyl]-trimethylazanium Traditional Name: [6-(6-bromo-2-methoxy-3-quinolyl)-5-hydroxy-5,6-diphenyl-hexyl]-trimethyl-ammonium Formula: C31H36BrN2O2+ MolecularWeight: 548.53374

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCCCC(C1=CC=CC=C1)(C(C2=CC=CC=C2)C3=C(N=C4C=CC(=CC4=C3)Br)OC)O

Isomeric SMILES

C[N+](C)(C)CCCCC(C1=CC=CC=C1)(C(C2=CC=CC=C2)C3=C(N=C4C=CC(=CC4=C3)Br)OC)O

InChI

InChI=1S/C31H36BrN2O2/c1-34(2,3)20-12-11-19-31(35,25-15-9-6-10-16-25)29(23-13-7-5-8-14-23)27-22-24-21-26(32)17-18-28(24)33-30(27)36-4/h5-10,13-18,21-22,29,35H,11-12,19-20H2,1-4H3/q+1