1-ethyl-4-[4-(2-phenylphenoxy)butyl]piperazin-4-ium

Systemtic Name: 1-ethyl-4-[4-(2-phenylphenoxy)butyl]piperazin-4-ium Openeye Name: 1-ethyl-4-[4-(2-phenylphenoxy)butyl]piperazin-4-ium CAS Name: 1-ethyl-4-[4-(2-phenylphenoxy)butyl]piperazin-4-ium IUPAC Name: 1-ethyl-4-[4-(2-phenylphenoxy)butyl]piperazin-4-ium Traditional Name: 1-ethyl-4-[4-(2-phenylphenoxy)butyl]piperazin-4-ium Formula: C22H31N2O+ MolecularWeight: 339.49434

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC[NH+](CC1)CCCCOC2=CC=CC=C2C3=CC=CC=C3

Isomeric SMILES

CCN1CC[NH+](CC1)CCCCOC2=CC=CC=C2C3=CC=CC=C3

InChI

InChI=1S/C22H30N2O/c1-2-23-15-17-24(18-16-23)14-8-9-19-25-22-13-7-6-12-21(22)20-10-4-3-5-11-20/h3-7,10-13H,2,8-9,14-19H2,1H3/p+1