1-[(4-ethoxyphenyl)methyl]-4-(pyridin-2-ylmethyl)piperazine-1,4-diium

Systemtic Name: 1-[(4-ethoxyphenyl)methyl]-4-(pyridin-2-ylmethyl)piperazine-1,4-diium Openeye Name: 1-[(4-ethoxyphenyl)methyl]-4-(2-pyridylmethyl)piperazine-1,4-diium CAS Name: 1-[(4-ethoxyphenyl)methyl]-4-(2-pyridinylmethyl)piperazine-1,4-diium IUPAC Name: 1-[(4-ethoxyphenyl)methyl]-4-(pyridin-2-ylmethyl)piperazine-1,4-diium Traditional Name: 1-(4-ethoxybenzyl)-4-(2-pyridylmethyl)piperazine-1,4-diium Formula: C19H27N3O+2 MolecularWeight: 313.43718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)CC3=CC=CC=N3

Isomeric SMILES

CCOC1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)CC3=CC=CC=N3

InChI

InChI=1S/C19H25N3O/c1-2-23-19-8-6-17(7-9-19)15-21-11-13-22(14-12-21)16-18-5-3-4-10-20-18/h3-10H,2,11-16H2,1H3/p+2