1-(3-phenoxypropyl)piperazine-1,4-diium

Systemtic Name: 1-(3-phenoxypropyl)piperazine-1,4-diium Openeye Name: 1-(3-phenoxypropyl)piperazine-1,4-diium CAS Name: 1-(3-phenoxypropyl)piperazine-1,4-diium IUPAC Name: 1-(3-phenoxypropyl)piperazine-1,4-diium Traditional Name: 1-(3-phenoxypropyl)piperazine-1,4-diium Formula: C13H22N2O+2 MolecularWeight: 222.32658

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH2+]1)CCCOC2=CC=CC=C2

Isomeric SMILES

C1C[NH+](CC[NH2+]1)CCCOC2=CC=CC=C2

InChI

InChI=1S/C13H20N2O/c1-2-5-13(6-3-1)16-12-4-9-15-10-7-14-8-11-15/h1-3,5-6,14H,4,7-12H2/p+2