(3,3-dimethyl-2-oxidanylidene-butyl)-diethyl-(3-phenylprop-2-ynyl)azanium

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl)-diethyl-(3-phenylprop-2-ynyl)azanium Openeye Name: (3,3-dimethyl-2-oxo-butyl)-diethyl-(3-phenylprop-2-ynyl)ammonium CAS Name: (3,3-dimethyl-2-oxobutyl)-diethyl-(3-phenylprop-2-ynyl)ammonium IUPAC Name: (3,3-dimethyl-2-oxobutyl)-diethyl-(3-phenylprop-2-ynyl)azanium Traditional Name: diethyl-(2-keto-3,3-dimethyl-butyl)-(3-phenylprop-2-ynyl)ammonium Formula: C19H28NO+ MolecularWeight: 286.43172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC#CC1=CC=CC=C1)CC(=O)C(C)(C)C

Isomeric SMILES

CC[N+](CC)(CC#CC1=CC=CC=C1)CC(=O)C(C)(C)C

InChI

InChI=1S/C19H28NO/c1-6-20(7-2,16-18(21)19(3,4)5)15-11-14-17-12-9-8-10-13-17/h8-10,12-13H,6-7,15-16H2,1-5H3/q+1