4-(3,4-dimethoxyphenyl)piperidin-1-ium

Systemtic Name: 4-(3,4-dimethoxyphenyl)piperidin-1-ium Openeye Name: 4-(3,4-dimethoxyphenyl)piperidin-1-ium CAS Name: 4-(3,4-dimethoxyphenyl)piperidin-1-ium IUPAC Name: 4-(3,4-dimethoxyphenyl)piperidin-1-ium Traditional Name: 4-(3,4-dimethoxyphenyl)piperidin-1-ium Formula: C13H20NO2+ MolecularWeight: 222.3034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC[NH2+]CC2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CC[NH2+]CC2)OC

InChI

InChI=1S/C13H19NO2/c1-15-12-4-3-11(9-13(12)16-2)10-5-7-14-8-6-10/h3-4,9-10,14H,5-8H2,1-2H3/p+1