3-(4-tert-butylphenyl)-1,4-dimethyl-1-(3,5,5-trimethylhexyl)pyrrolidin-1-ium

Systemtic Name: 3-(4-tert-butylphenyl)-1,4-dimethyl-1-(3,5,5-trimethylhexyl)pyrrolidin-1-ium Openeye Name: 3-(4-tert-butylphenyl)-1,4-dimethyl-1-(3,5,5-trimethylhexyl)pyrrolidin-1-ium CAS Name: 3-(4-tert-butylphenyl)-1,4-dimethyl-1-(3,5,5-trimethylhexyl)pyrrolidin-1-ium IUPAC Name: 3-(4-tert-butylphenyl)-1,4-dimethyl-1-(3,5,5-trimethylhexyl)pyrrolidin-1-ium Traditional Name: 3-(4-tert-butylphenyl)-1,4-dimethyl-1-(3,5,5-trimethylhexyl)pyrrolidin-1-ium Formula: C25H44N+ MolecularWeight: 358.62356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C[N+](CC1C2=CC=C(C=C2)C(C)(C)C)(C)CCC(C)CC(C)(C)C

Isomeric SMILES

CC1C[N+](CC1C2=CC=C(C=C2)C(C)(C)C)(C)CCC(C)CC(C)(C)C

InChI

InChI=1S/C25H44N/c1-19(16-24(3,4)5)14-15-26(9)17-20(2)23(18-26)21-10-12-22(13-11-21)25(6,7)8/h10-13,19-20,23H,14-18H2,1-9H3/q+1