(3S)-3-(4-ethoxyphenoxy)piperidin-1-ium

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC2CCC[NH2+]C2

Isomeric SMILES

CCOC1=CC=C(C=C1)O[C@H]2CCC[NH2+]C2

InChI

InChI=1S/C13H19NO2/c1-2-15-11-5-7-12(8-6-11)16-13-4-3-9-14-10-13/h5-8,13-14H,2-4,9-10H2,1H3/p+1/t13-/m0/s1