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

Systemtic Name: 1-(4-aminocarbonyl-2-phenyl-phenyl)ethyl-[2-(3-butylisoquinolin-1-yl)oxyethyl]-dimethyl-azanium Openeye Name: 2-[(3-butyl-1-isoquinolyl)oxy]ethyl-[1-(4-carbamoyl-2-phenyl-phenyl)ethyl]-dimethyl-ammonium CAS Name: 2-[(3-butyl-1-isoquinolinyl)oxy]ethyl-[1-(4-carbamoyl-2-phenylphenyl)ethyl]-dimethylammonium IUPAC Name: 2-(3-butylisoquinolin-1-yl)oxyethyl-[1-(4-carbamoyl-2-phenylphenyl)ethyl]-dimethylazanium Traditional Name: 2-[(3-butyl-1-isoquinolyl)oxy]ethyl-[1-(4-carbamoyl-2-phenyl-phenyl)ethyl]-dimethyl-ammonium Formula: C32H38N3O2+ MolecularWeight: 496.66302

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C32H37N3O2/c1-5-6-15-27-21-25-14-10-11-16-29(25)32(34-27)37-20-19-35(3,4)23(2)28-18-17-26(31(33)36)22-30(28)24-12-8-7-9-13-24/h7-14,16-18,21-23H,5-6,15,19-20H2,1-4H3,(H-,33,36)/p+1