1-ethyl-4-[(3-phenylmethoxyphenyl)methyl]piperazin-1-ium

Systemtic Name: 1-ethyl-4-[(3-phenylmethoxyphenyl)methyl]piperazin-1-ium Openeye Name: 1-[(3-benzyloxyphenyl)methyl]-4-ethyl-piperazin-4-ium CAS Name: 1-ethyl-4-[(3-phenylmethoxyphenyl)methyl]piperazin-1-ium IUPAC Name: 1-ethyl-4-[(3-phenylmethoxyphenyl)methyl]piperazin-1-ium Traditional Name: 1-(3-benzoxybenzyl)-4-ethyl-piperazin-4-ium Formula: C20H27N2O+ MolecularWeight: 311.44118

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC2=CC(=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=CC(=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C20H26N2O/c1-2-21-11-13-22(14-12-21)16-19-9-6-10-20(15-19)23-17-18-7-4-3-5-8-18/h3-10,15H,2,11-14,16-17H2,1H3/p+1