[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-(3-methylbutyl)azanium

Systemtic Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-(3-methylbutyl)azanium Openeye Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-isopentyl-ammonium CAS Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-(3-methylbutyl)ammonium IUPAC Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-(3-methylbutyl)azanium Traditional Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]-isoamyl-ammonium Formula: C16H25N2O+ MolecularWeight: 261.3825

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC[NH2+]CC(=O)N1CCC2=CC=CC=C2C1

Isomeric SMILES

CC(C)CC[NH2+]CC(=O)N1CCC2=CC=CC=C2C1

InChI

InChI=1S/C16H24N2O/c1-13(2)7-9-17-11-16(19)18-10-8-14-5-3-4-6-15(14)12-18/h3-6,13,17H,7-12H2,1-2H3/p+1