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

Systemtic Name: 1-[(3-phenoxyphenyl)methyl]piperazin-4-ium Openeye Name: 1-[(3-phenoxyphenyl)methyl]piperazin-4-ium CAS Name: 1-[(3-phenoxyphenyl)methyl]piperazin-4-ium IUPAC Name: 1-[(3-phenoxyphenyl)methyl]piperazin-4-ium Traditional Name: 1-(3-phenoxybenzyl)piperazin-4-ium Formula: C17H21N2O+ MolecularWeight: 269.36144

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)CC2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH2+]1)CC2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C17H20N2O/c1-2-6-16(7-3-1)20-17-8-4-5-15(13-17)14-19-11-9-18-10-12-19/h1-8,13,18H,9-12,14H2/p+1