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

Systemtic Name: 1-[(2-methoxyphenyl)methyl]-4-(pyridin-2-ylmethyl)piperazine-1,4-diium Openeye Name: 1-[(2-methoxyphenyl)methyl]-4-(2-pyridylmethyl)piperazine-1,4-diium CAS Name: 1-[(2-methoxyphenyl)methyl]-4-(2-pyridinylmethyl)piperazine-1,4-diium IUPAC Name: 1-[(2-methoxyphenyl)methyl]-4-(pyridin-2-ylmethyl)piperazine-1,4-diium Traditional Name: 1-o-anisyl-4-(2-pyridylmethyl)piperazine-1,4-diium Formula: C18H25N3O+2 MolecularWeight: 299.4106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C[NH+]2CC[NH+](CC2)CC3=CC=CC=N3

Isomeric SMILES

COC1=CC=CC=C1C[NH+]2CC[NH+](CC2)CC3=CC=CC=N3

InChI

InChI=1S/C18H23N3O/c1-22-18-8-3-2-6-16(18)14-20-10-12-21(13-11-20)15-17-7-4-5-9-19-17/h2-9H,10-15H2,1H3/p+2