1-[(3-phenoxyphenyl)methyl]-4-(pyridin-2-ylmethyl)piperazin-4-ium

Systemtic Name: 1-[(3-phenoxyphenyl)methyl]-4-(pyridin-2-ylmethyl)piperazin-4-ium Openeye Name: 1-[(3-phenoxyphenyl)methyl]-4-(2-pyridylmethyl)piperazin-4-ium CAS Name: 1-[(3-phenoxyphenyl)methyl]-4-(2-pyridinylmethyl)piperazin-4-ium IUPAC Name: 1-[(3-phenoxyphenyl)methyl]-4-(pyridin-2-ylmethyl)piperazin-4-ium Traditional Name: 1-(3-phenoxybenzyl)-4-(2-pyridylmethyl)piperazin-4-ium Formula: C23H26N3O+ MolecularWeight: 360.47204

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=N2)CC3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=N2)CC3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C23H25N3O/c1-2-9-22(10-3-1)27-23-11-6-7-20(17-23)18-25-13-15-26(16-14-25)19-21-8-4-5-12-24-21/h1-12,17H,13-16,18-19H2/p+1