2-(3-chloranylphenoxy)-1-ethyl-1-pentyl-piperidin-1-ium-3-ol

Systemtic Name: 2-(3-chloranylphenoxy)-1-ethyl-1-pentyl-piperidin-1-ium-3-ol Openeye Name: 2-(3-chlorophenoxy)-1-ethyl-1-pentyl-piperidin-1-ium-3-ol CAS Name: 2-(3-chlorophenoxy)-1-ethyl-1-pentyl-3-piperidin-1-iumol IUPAC Name: 2-(3-chlorophenoxy)-1-ethyl-1-pentylpiperidin-1-ium-3-ol Traditional Name: 1-amyl-2-(3-chlorophenoxy)-1-ethyl-piperidin-1-ium-3-ol Formula: C18H29ClNO2+ MolecularWeight: 326.88136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[N+]1(CCCC(C1OC2=CC(=CC=C2)Cl)O)CC

Isomeric SMILES

CCCCC[N+]1(CCCC(C1OC2=CC(=CC=C2)Cl)O)CC

InChI

InChI=1S/C18H29ClNO2/c1-3-5-6-12-20(4-2)13-8-11-17(21)18(20)22-16-10-7-9-15(19)14-16/h7,9-10,14,17-18,21H,3-6,8,11-13H2,1-2H3/q+1