3-[(2S)-1-[4-(4-methoxyphenoxy)butyl]piperidin-1-ium-2-yl]pyridine

Systemtic Name: 3-[(2S)-1-[4-(4-methoxyphenoxy)butyl]piperidin-1-ium-2-yl]pyridine Openeye Name: 3-[(2S)-1-[4-(4-methoxyphenoxy)butyl]piperidin-1-ium-2-yl]pyridine CAS Name: 3-[(2S)-1-[4-(4-methoxyphenoxy)butyl]-2-piperidin-1-iumyl]pyridine IUPAC Name: 3-[(2S)-1-[4-(4-methoxyphenoxy)butyl]piperidin-1-ium-2-yl]pyridine Traditional Name: 3-[(2S)-1-[4-(4-methoxyphenoxy)butyl]piperidin-1-ium-2-yl]pyridine Formula: C21H29N2O2+ MolecularWeight: 341.46716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCCCC[NH+]2CCCCC2C3=CN=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)OCCCC[NH+]2CCCC[C@H]2C3=CN=CC=C3

InChI

InChI=1S/C21H28N2O2/c1-24-19-9-11-20(12-10-19)25-16-5-4-15-23-14-3-2-8-21(23)18-7-6-13-22-17-18/h6-7,9-13,17,21H,2-5,8,14-16H2,1H3/p+1/t21-/m0/s1