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

Systemtic Name: 1-methyl-4-[3-(2-phenylphenoxy)propyl]piperazine-1,4-diium Openeye Name: 1-methyl-4-[3-(2-phenylphenoxy)propyl]piperazine-1,4-diium CAS Name: 1-methyl-4-[3-(2-phenylphenoxy)propyl]piperazine-1,4-diium IUPAC Name: 1-methyl-4-[3-(2-phenylphenoxy)propyl]piperazine-1,4-diium Traditional Name: 1-methyl-4-[3-(2-phenylphenoxy)propyl]piperazine-1,4-diium Formula: C20H28N2O+2 MolecularWeight: 312.44912

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CCCOC2=CC=CC=C2C3=CC=CC=C3

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CCCOC2=CC=CC=C2C3=CC=CC=C3

InChI

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