1-ethyl-4-[3-(3-phenoxyphenoxy)propyl]piperazin-1-ium

Systemtic Name: 1-ethyl-4-[3-(3-phenoxyphenoxy)propyl]piperazin-1-ium Openeye Name: 1-ethyl-4-[3-(3-phenoxyphenoxy)propyl]piperazin-1-ium CAS Name: 1-ethyl-4-[3-(3-phenoxyphenoxy)propyl]piperazin-1-ium IUPAC Name: 1-ethyl-4-[3-(3-phenoxyphenoxy)propyl]piperazin-1-ium Traditional Name: 1-ethyl-4-[3-(3-phenoxyphenoxy)propyl]piperazin-1-ium Formula: C21H29N2O2+ MolecularWeight: 341.46716

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CCCOC2=CC=CC(=C2)OC3=CC=CC=C3

Isomeric SMILES

CC[NH+]1CCN(CC1)CCCOC2=CC=CC(=C2)OC3=CC=CC=C3

InChI

InChI=1S/C21H28N2O2/c1-2-22-13-15-23(16-14-22)12-7-17-24-20-10-6-11-21(18-20)25-19-8-4-3-5-9-19/h3-6,8-11,18H,2,7,12-17H2,1H3/p+1