1-(4-aminocarbonyl-2-phenyl-phenyl)butyl-[2-(3-butylisoquinolin-1-yl)oxyethyl]-dimethyl-azanium

Systemtic Name: 1-(4-aminocarbonyl-2-phenyl-phenyl)butyl-[2-(3-butylisoquinolin-1-yl)oxyethyl]-dimethyl-azanium Openeye Name: 2-[(3-butyl-1-isoquinolyl)oxy]ethyl-[1-(4-carbamoyl-2-phenyl-phenyl)butyl]-dimethyl-ammonium CAS Name: 2-[(3-butyl-1-isoquinolinyl)oxy]ethyl-[1-(4-carbamoyl-2-phenylphenyl)butyl]-dimethylammonium IUPAC Name: 2-(3-butylisoquinolin-1-yl)oxyethyl-[1-(4-carbamoyl-2-phenylphenyl)butyl]-dimethylazanium Traditional Name: 2-[(3-butyl-1-isoquinolyl)oxy]ethyl-[1-(4-carbamoyl-2-phenyl-phenyl)butyl]-dimethyl-ammonium Formula: C34H42N3O2+ MolecularWeight: 524.71618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C34H41N3O2/c1-5-7-17-28-23-26-16-11-12-18-29(26)34(36-28)39-22-21-37(3,4)32(13-6-2)30-20-19-27(33(35)38)24-31(30)25-14-9-8-10-15-25/h8-12,14-16,18-20,23-24,32H,5-7,13,17,21-22H2,1-4H3,(H-,35,38)/p+1