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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=NC=C2)CC3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=NC=C2)CC3=CC(=CC=C3)OC4=CC=CC=C4

InChI

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