[(1S)-1-(3,4-dimethoxyphenyl)propyl]-prop-2-ynyl-azanium

Systemtic Name: [(1S)-1-(3,4-dimethoxyphenyl)propyl]-prop-2-ynyl-azanium Openeye Name: [(1S)-1-(3,4-dimethoxyphenyl)propyl]-prop-2-ynyl-ammonium CAS Name: [(1S)-1-(3,4-dimethoxyphenyl)propyl]-prop-2-ynylammonium IUPAC Name: [(1S)-1-(3,4-dimethoxyphenyl)propyl]-prop-2-ynylazanium Traditional Name: [(1S)-1-(3,4-dimethoxyphenyl)propyl]-propargyl-ammonium Formula: C14H20NO2+ MolecularWeight: 234.3141

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=C(C=C1)OC)OC)[NH2+]CC#C

Isomeric SMILES

CC[C@@H](C1=CC(=C(C=C1)OC)OC)[NH2+]CC#C

InChI

InChI=1S/C14H19NO2/c1-5-9-15-12(6-2)11-7-8-13(16-3)14(10-11)17-4/h1,7-8,10,12,15H,6,9H2,2-4H3/p+1/t12-/m0/s1