1-methyl-4-[3-(4-phenylphenoxy)propyl]piperazin-1-ium

Systemtic Name: 1-methyl-4-[3-(4-phenylphenoxy)propyl]piperazin-1-ium Openeye Name: 1-methyl-4-[3-(4-phenylphenoxy)propyl]piperazin-1-ium CAS Name: 1-methyl-4-[3-(4-phenylphenoxy)propyl]piperazin-1-ium IUPAC Name: 1-methyl-4-[3-(4-phenylphenoxy)propyl]piperazin-1-ium Traditional Name: 1-methyl-4-[3-(4-phenylphenoxy)propyl]piperazin-1-ium Formula: C20H27N2O+ MolecularWeight: 311.44118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N2O/c1-21-13-15-22(16-14-21)12-5-17-23-20-10-8-19(9-11-20)18-6-3-2-4-7-18/h2-4,6-11H,5,12-17H2,1H3/p+1