1-methyl-4-[2-[4-(phenylmethyl)phenoxy]ethyl]piperazin-1-ium

Systemtic Name: 1-methyl-4-[2-[4-(phenylmethyl)phenoxy]ethyl]piperazin-1-ium Openeye Name: 1-[2-(4-benzylphenoxy)ethyl]-4-methyl-piperazin-4-ium CAS Name: 1-methyl-4-[2-[4-(phenylmethyl)phenoxy]ethyl]piperazin-1-ium IUPAC Name: 1-[2-(4-benzylphenoxy)ethyl]-4-methylpiperazin-4-ium Traditional Name: 1-[2-(4-benzylphenoxy)ethyl]-4-methyl-piperazin-4-ium Formula: C20H27N2O+ MolecularWeight: 311.44118

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCOC2=CC=C(C=C2)CC3=CC=CC=C3

Isomeric SMILES

C[NH+]1CCN(CC1)CCOC2=CC=C(C=C2)CC3=CC=CC=C3

InChI

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