1-methyl-4-[3-(2-phenylmethoxyphenoxy)propyl]piperazine-1,4-diium

Systemtic Name: 1-methyl-4-[3-(2-phenylmethoxyphenoxy)propyl]piperazine-1,4-diium Openeye Name: 1-[3-(2-benzyloxyphenoxy)propyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-methyl-4-[3-(2-phenylmethoxyphenoxy)propyl]piperazine-1,4-diium IUPAC Name: 1-methyl-4-[3-(2-phenylmethoxyphenoxy)propyl]piperazine-1,4-diium Traditional Name: 1-[3-(2-benzoxyphenoxy)propyl]-4-methyl-piperazine-1,4-diium Formula: C21H30N2O2+2 MolecularWeight: 342.4751

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CCCOC2=CC=CC=C2OCC3=CC=CC=C3

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CCCOC2=CC=CC=C2OCC3=CC=CC=C3

InChI

InChI=1S/C21H28N2O2/c1-22-13-15-23(16-14-22)12-7-17-24-20-10-5-6-11-21(20)25-18-19-8-3-2-4-9-19/h2-6,8-11H,7,12-18H2,1H3/p+2