[(3S)-3-(3,4-dimethoxyphenyl)-3-pyrrolidin-1-ium-1-yl-propyl]azanium

Systemtic Name: [(3S)-3-(3,4-dimethoxyphenyl)-3-pyrrolidin-1-ium-1-yl-propyl]azanium Openeye Name: [(3S)-3-(3,4-dimethoxyphenyl)-3-pyrrolidin-1-ium-1-yl-propyl]ammonium CAS Name: [(3S)-3-(3,4-dimethoxyphenyl)-3-(1-pyrrolidin-1-iumyl)propyl]ammonium IUPAC Name: [(3S)-3-(3,4-dimethoxyphenyl)-3-pyrrolidin-1-ium-1-ylpropyl]azanium Traditional Name: [(3S)-3-(3,4-dimethoxyphenyl)-3-pyrrolidin-1-ium-1-yl-propyl]ammonium Formula: C15H26N2O2+2 MolecularWeight: 266.37914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC[NH3+])[NH+]2CCCC2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@H](CC[NH3+])[NH+]2CCCC2)OC

InChI

InChI=1S/C15H24N2O2/c1-18-14-6-5-12(11-15(14)19-2)13(7-8-16)17-9-3-4-10-17/h5-6,11,13H,3-4,7-10,16H2,1-2H3/p+2/t13-/m0/s1