[4-(6-bromanyl-2-methoxy-quinolin-3-yl)-3-oxidanyl-3,4-diphenyl-butyl]-trimethyl-azanium

Systemtic Name: [4-(6-bromanyl-2-methoxy-quinolin-3-yl)-3-oxidanyl-3,4-diphenyl-butyl]-trimethyl-azanium Openeye Name: [4-(6-bromo-2-methoxy-3-quinolyl)-3-hydroxy-3,4-diphenyl-butyl]-trimethyl-ammonium CAS Name: [4-(6-bromo-2-methoxy-3-quinolinyl)-3-hydroxy-3,4-diphenylbutyl]-trimethylammonium IUPAC Name: [4-(6-bromo-2-methoxyquinolin-3-yl)-3-hydroxy-3,4-diphenylbutyl]-trimethylazanium Traditional Name: [4-(6-bromo-2-methoxy-3-quinolyl)-3-hydroxy-3,4-diphenyl-butyl]-trimethyl-ammonium Formula: C29H32BrN2O2+ MolecularWeight: 520.48058

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C29H32BrN2O2/c1-32(2,3)18-17-29(33,23-13-9-6-10-14-23)27(21-11-7-5-8-12-21)25-20-22-19-24(30)15-16-26(22)31-28(25)34-4/h5-16,19-20,27,33H,17-18H2,1-4H3/q+1