(1-azaniumyl-2-methyl-propan-2-yl)-methyl-(phenylmethyl)azanium

Systemtic Name: (1-azaniumyl-2-methyl-propan-2-yl)-methyl-(phenylmethyl)azanium Openeye Name: (2-azaniumyl-1,1-dimethyl-ethyl)-benzyl-methyl-ammonium CAS Name: (1-ammonio-2-methylpropan-2-yl)-methyl-(phenylmethyl)ammonium IUPAC Name: (1-azaniumyl-2-methylpropan-2-yl)-benzyl-methylazanium Traditional Name: (2-ammonio-1,1-dimethyl-ethyl)-benzyl-methyl-ammonium Formula: C12H22N2+2 MolecularWeight: 194.31648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C[NH3+])[NH+](C)CC1=CC=CC=C1

Isomeric SMILES

CC(C)(C[NH3+])[NH+](C)CC1=CC=CC=C1

InChI

InChI=1S/C12H20N2/c1-12(2,10-13)14(3)9-11-7-5-4-6-8-11/h4-8H,9-10,13H2,1-3H3/p+2