(8-azanyl-3-ethyl-4-methyl-8-oxidanylidene-7,7-diphenyl-octan-3-yl)azanium chloride

Systemtic Name: (8-azanyl-3-ethyl-4-methyl-8-oxidanylidene-7,7-diphenyl-octan-3-yl)azanium chloride Openeye Name: (6-amino-1,1-diethyl-2-methyl-6-oxo-5,5-diphenyl-hexyl)ammonium chloride CAS Name: (8-amino-3-ethyl-4-methyl-8-oxo-7,7-diphenyloctan-3-yl)ammonium chloride IUPAC Name: (8-amino-3-ethyl-4-methyl-8-oxo-7,7-diphenyloctan-3-yl)azanium chloride Traditional Name: (6-amino-1,1-diethyl-6-keto-2-methyl-5,5-diphenyl-hexyl)ammonium chloride Formula: C23H33ClN2O MolecularWeight: 388.97392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C(C)CCC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)N)[NH3+].[Cl-]

Isomeric SMILES

CCC(CC)(C(C)CCC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)N)[NH3+].[Cl-]

InChI

InChI=1S/C23H32N2O.ClH/c1-4-22(25,5-2)18(3)16-17-23(21(24)26,19-12-8-6-9-13-19)20-14-10-7-11-15-20;/h6-15,18H,4-5,16-17,25H2,1-3H3,(H2,24,26);1H