methyl sulfate; trimethyl-[(2-methylimidazo[2,1-a]isoquinolin-3-yl)methyl]azanium

Systemtic Name: methyl sulfate; trimethyl-[(2-methylimidazo[2,1-a]isoquinolin-3-yl)methyl]azanium Openeye Name: methyl sulfate; trimethyl-[(2-methylimidazo[2,1-a]isoquinolin-3-yl)methyl]ammonium CAS Name: methyl sulfate; trimethyl-[(2-methyl-3-imidazo[2,1-a]isoquinolinyl)methyl]ammonium IUPAC Name: methyl sulfate; trimethyl-[(2-methylimidazo[2,1-a]isoquinolin-3-yl)methyl]azanium Traditional Name: methyl sulfate; trimethyl-[(2-methylimidaz[2,1-a]isoquinolin-3-yl)methyl]ammonium Formula: C17H23N3O4S MolecularWeight: 365.44722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C=CC3=CC=CC=C3C2=N1)C[N+](C)(C)C.COS(=O)(=O)[O-]

Isomeric SMILES

CC1=C(N2C=CC3=CC=CC=C3C2=N1)C[N+](C)(C)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C16H20N3.CH4O4S/c1-12-15(11-19(2,3)4)18-10-9-13-7-5-6-8-14(13)16(18)17-12;1-5-6(2,3)4/h5-10H,11H2,1-4H3;1H3,(H,2,3,4)/q+1;/p-1