[3-[(6-bromanyl-2-methoxy-quinolin-3-yl)-phenyl-methyl]-3-oxidanyl-5-phenyl-pentyl]-trimethyl-azanium

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

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCC(CCC1=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(CCC1=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)20-19-31(35,18-17-23-11-7-5-8-12-23)29(24-13-9-6-10-14-24)27-22-25-21-26(32)15-16-28(25)33-30(27)36-4/h5-16,21-22,29,35H,17-20H2,1-4H3/q+1