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

Systemtic Name: 1-(2-ethoxyphenyl)-4-[(2-ethoxyphenyl)methyl]piperazin-4-ium Openeye Name: 1-(2-ethoxyphenyl)-4-[(2-ethoxyphenyl)methyl]piperazin-4-ium CAS Name: 1-(2-ethoxyphenyl)-4-[(2-ethoxyphenyl)methyl]piperazin-4-ium IUPAC Name: 1-(2-ethoxyphenyl)-4-[(2-ethoxyphenyl)methyl]piperazin-4-ium Traditional Name: 1-(2-ethoxybenzyl)-4-o-phenetyl-piperazin-1-ium Formula: C21H29N2O2+ MolecularWeight: 341.46716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C[NH+]2CCN(CC2)C3=CC=CC=C3OCC

Isomeric SMILES

CCOC1=CC=CC=C1C[NH+]2CCN(CC2)C3=CC=CC=C3OCC

InChI

InChI=1S/C21H28N2O2/c1-3-24-20-11-7-5-9-18(20)17-22-13-15-23(16-14-22)19-10-6-8-12-21(19)25-4-2/h5-12H,3-4,13-17H2,1-2H3/p+1