(4-aminocarbonyl-2-phenyl-2,3-dihydro-1H-inden-1-yl)-[2-(3-butylisoquinolin-1-yl)oxyethyl]-dimethyl-azanium

Systemtic Name: (4-aminocarbonyl-2-phenyl-2,3-dihydro-1H-inden-1-yl)-[2-(3-butylisoquinolin-1-yl)oxyethyl]-dimethyl-azanium Openeye Name: 2-[(3-butyl-1-isoquinolyl)oxy]ethyl-(4-carbamoyl-2-phenyl-indan-1-yl)-dimethyl-ammonium CAS Name: 2-[(3-butyl-1-isoquinolinyl)oxy]ethyl-(4-carbamoyl-2-phenyl-2,3-dihydro-1H-inden-1-yl)-dimethylammonium IUPAC Name: 2-(3-butylisoquinolin-1-yl)oxyethyl-(4-carbamoyl-2-phenyl-2,3-dihydro-1H-inden-1-yl)-dimethylazanium Traditional Name: 2-[(3-butyl-1-isoquinolyl)oxy]ethyl-(4-carbamoyl-2-phenyl-indan-1-yl)-dimethyl-ammonium Formula: C33H38N3O2+ MolecularWeight: 508.67372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=CC=CC=C2C(=N1)OCC[N+](C)(C)C3C(CC4=C(C=CC=C34)C(=O)N)C5=CC=CC=C5

Isomeric SMILES

CCCCC1=CC2=CC=CC=C2C(=N1)OCC[N+](C)(C)C3C(CC4=C(C=CC=C34)C(=O)N)C5=CC=CC=C5

InChI

InChI=1S/C33H37N3O2/c1-4-5-15-25-21-24-14-9-10-16-26(24)33(35-25)38-20-19-36(2,3)31-27-17-11-18-28(32(34)37)30(27)22-29(31)23-12-7-6-8-13-23/h6-14,16-18,21,29,31H,4-5,15,19-20,22H2,1-3H3,(H-,34,37)/p+1