2-(5-azido-3-butyl-isoquinolin-1-yl)oxyethyl-trimethyl-azanium

Systemtic Name: 2-(5-azido-3-butyl-isoquinolin-1-yl)oxyethyl-trimethyl-azanium Openeye Name: 2-[(5-azido-3-butyl-1-isoquinolyl)oxy]ethyl-trimethyl-ammonium CAS Name: 2-[(5-azido-3-butyl-1-isoquinolinyl)oxy]ethyl-trimethylammonium IUPAC Name: 2-(5-azido-3-butylisoquinolin-1-yl)oxyethyl-trimethylazanium Traditional Name: 2-[(5-azido-3-butyl-1-isoquinolyl)oxy]ethyl-trimethyl-ammonium Formula: C18H26N5O+ MolecularWeight: 328.43194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C2C=CC=C(C2=C1)N=[N+]=[N-])OCC[N+](C)(C)C

Isomeric SMILES

CCCCC1=NC(=C2C=CC=C(C2=C1)N=[N+]=[N-])OCC[N+](C)(C)C

InChI

InChI=1S/C18H26N5O/c1-5-6-8-14-13-16-15(9-7-10-17(16)21-22-19)18(20-14)24-12-11-23(2,3)4/h7,9-10,13H,5-6,8,11-12H2,1-4H3/q+1