1-(4-aminocarbonyl-6-bromanyl-3-methyl-2-phenyl-phenyl)propyl-[2-(3-butylisoquinolin-1-yl)oxyethyl]-dimethyl-azanium

Systemtic Name: 1-(4-aminocarbonyl-6-bromanyl-3-methyl-2-phenyl-phenyl)propyl-[2-(3-butylisoquinolin-1-yl)oxyethyl]-dimethyl-azanium Openeye Name: 1-(6-bromo-4-carbamoyl-3-methyl-2-phenyl-phenyl)propyl-[2-[(3-butyl-1-isoquinolyl)oxy]ethyl]-dimethyl-ammonium CAS Name: 1-(6-bromo-4-carbamoyl-3-methyl-2-phenylphenyl)propyl-[2-[(3-butyl-1-isoquinolinyl)oxy]ethyl]-dimethylammonium IUPAC Name: 1-(6-bromo-4-carbamoyl-3-methyl-2-phenylphenyl)propyl-[2-(3-butylisoquinolin-1-yl)oxyethyl]-dimethylazanium Traditional Name: 1-(6-bromo-4-carbamoyl-3-methyl-2-phenyl-phenyl)propyl-[2-[(3-butyl-1-isoquinolyl)oxy]ethyl]-dimethyl-ammonium Formula: C34H41BrN3O2+ MolecularWeight: 603.61224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=CC=CC=C2C(=N1)OCC[N+](C)(C)C(CC)C3=C(C=C(C(=C3C4=CC=CC=C4)C)C(=O)N)Br

Isomeric SMILES

CCCCC1=CC2=CC=CC=C2C(=N1)OCC[N+](C)(C)C(CC)C3=C(C=C(C(=C3C4=CC=CC=C4)C)C(=O)N)Br

InChI

InChI=1S/C34H40BrN3O2/c1-6-8-17-26-21-25-16-12-13-18-27(25)34(37-26)40-20-19-38(4,5)30(7-2)32-29(35)22-28(33(36)39)23(3)31(32)24-14-10-9-11-15-24/h9-16,18,21-22,30H,6-8,17,19-20H2,1-5H3,(H-,36,39)/p+1