2-(3-butylisoquinolin-1-yl)oxyethyl-dimethyl-prop-2-enyl-azanium

Systemtic Name: 2-(3-butylisoquinolin-1-yl)oxyethyl-dimethyl-prop-2-enyl-azanium Openeye Name: allyl-[2-[(3-butyl-1-isoquinolyl)oxy]ethyl]-dimethyl-ammonium CAS Name: 2-[(3-butyl-1-isoquinolinyl)oxy]ethyl-dimethyl-prop-2-enylammonium IUPAC Name: 2-(3-butylisoquinolin-1-yl)oxyethyl-dimethyl-prop-2-enylazanium Traditional Name: allyl-[2-[(3-butyl-1-isoquinolyl)oxy]ethyl]-dimethyl-ammonium Formula: C20H29N2O+ MolecularWeight: 313.45706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H29N2O/c1-5-7-11-18-16-17-10-8-9-12-19(17)20(21-18)23-15-14-22(3,4)13-6-2/h6,8-10,12,16H,2,5,7,11,13-15H2,1,3-4H3/q+1