[1-(4-aminophenyl)pyrrolidin-3-yl]-dimethyl-octyl-azanium

Systemtic Name: [1-(4-aminophenyl)pyrrolidin-3-yl]-dimethyl-octyl-azanium Openeye Name: [1-(4-aminophenyl)pyrrolidin-3-yl]-dimethyl-octyl-ammonium CAS Name: [1-(4-aminophenyl)-3-pyrrolidinyl]-dimethyl-octylammonium IUPAC Name: [1-(4-aminophenyl)pyrrolidin-3-yl]-dimethyl-octylazanium Traditional Name: [1-(4-aminophenyl)pyrrolidin-3-yl]-dimethyl-octyl-ammonium Formula: C20H36N3+ MolecularWeight: 318.51994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+](C)(C)C1CCN(C1)C2=CC=C(C=C2)N

Isomeric SMILES

CCCCCCCC[N+](C)(C)C1CCN(C1)C2=CC=C(C=C2)N

InChI

InChI=1S/C20H36N3/c1-4-5-6-7-8-9-16-23(2,3)20-14-15-22(17-20)19-12-10-18(21)11-13-19/h10-13,20H,4-9,14-17,21H2,1-3H3/q+1