1-(2-ethoxyphenyl)-4-[(4-phenylmethoxyphenyl)methyl]piperazin-4-ium

Systemtic Name: 1-(2-ethoxyphenyl)-4-[(4-phenylmethoxyphenyl)methyl]piperazin-4-ium Openeye Name: 1-[(4-benzyloxyphenyl)methyl]-4-(2-ethoxyphenyl)piperazin-1-ium CAS Name: 1-(2-ethoxyphenyl)-4-[(4-phenylmethoxyphenyl)methyl]piperazin-4-ium IUPAC Name: 1-(2-ethoxyphenyl)-4-[(4-phenylmethoxyphenyl)methyl]piperazin-4-ium Traditional Name: 1-(4-benzoxybenzyl)-4-o-phenetyl-piperazin-1-ium Formula: C26H31N2O2+ MolecularWeight: 403.53654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C26H30N2O2/c1-2-29-26-11-7-6-10-25(26)28-18-16-27(17-19-28)20-22-12-14-24(15-13-22)30-21-23-8-4-3-5-9-23/h3-15H,2,16-21H2,1H3/p+1