[(1S)-2-azaniumyl-1-(4-dimethylaminophenyl)ethyl]-bis(2-methylpropyl)azanium

Systemtic Name: [(1S)-2-azaniumyl-1-(4-dimethylaminophenyl)ethyl]-bis(2-methylpropyl)azanium Openeye Name: [(1S)-2-azaniumyl-1-(4-dimethylaminophenyl)ethyl]-diisobutyl-ammonium CAS Name: [(1S)-2-ammonio-1-(4-dimethylaminophenyl)ethyl]-bis(2-methylpropyl)ammonium IUPAC Name: [(1S)-2-azaniumyl-1-(4-dimethylaminophenyl)ethyl]-bis(2-methylpropyl)azanium Traditional Name: [(1S)-2-ammonio-1-(4-dimethylaminophenyl)ethyl]-diisobutyl-ammonium Formula: C18H35N3+2 MolecularWeight: 293.4906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)C[NH+](CC(C)C)[C@H](C[NH3+])C1=CC=C(C=C1)N(C)C

InChI

InChI=1S/C18H33N3/c1-14(2)12-21(13-15(3)4)18(11-19)16-7-9-17(10-8-16)20(5)6/h7-10,14-15,18H,11-13,19H2,1-6H3/p+2/t18-/m1/s1