4-methyl-1-[3-(4-phenylmethoxyphenoxy)propyl]piperidin-1-ium

Systemtic Name: 4-methyl-1-[3-(4-phenylmethoxyphenoxy)propyl]piperidin-1-ium Openeye Name: 1-[3-(4-benzyloxyphenoxy)propyl]-4-methyl-piperidin-1-ium CAS Name: 4-methyl-1-[3-(4-phenylmethoxyphenoxy)propyl]piperidin-1-ium IUPAC Name: 4-methyl-1-[3-(4-phenylmethoxyphenoxy)propyl]piperidin-1-ium Traditional Name: 1-[3-(4-benzoxyphenoxy)propyl]-4-methyl-piperidin-1-ium Formula: C22H30NO2+ MolecularWeight: 340.4791

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCCOC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC1CC[NH+](CC1)CCCOC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C22H29NO2/c1-19-12-15-23(16-13-19)14-5-17-24-21-8-10-22(11-9-21)25-18-20-6-3-2-4-7-20/h2-4,6-11,19H,5,12-18H2,1H3/p+1