2-(4-methoxyphenyl)-4,6-bis(piperidin-1-ium-1-ylmethyl)pyridin-3-olate

Systemtic Name: 2-(4-methoxyphenyl)-4,6-bis(piperidin-1-ium-1-ylmethyl)pyridin-3-olate Openeye Name: 2-(4-methoxyphenyl)-4,6-bis(piperidin-1-ium-1-ylmethyl)pyridin-3-olate CAS Name: 2-(4-methoxyphenyl)-4,6-bis(1-piperidin-1-iumylmethyl)-3-pyridinolate IUPAC Name: 2-(4-methoxyphenyl)-4,6-bis(piperidin-1-ium-1-ylmethyl)pyridin-3-olate Traditional Name: 2-(4-methoxyphenyl)-4,6-bis(piperidin-1-ium-1-ylmethyl)pyridin-3-olate Formula: C24H34N3O2+ MolecularWeight: 396.54566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=CC(=N2)C[NH+]3CCCCC3)C[NH+]4CCCCC4)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=CC(=N2)C[NH+]3CCCCC3)C[NH+]4CCCCC4)[O-]

InChI

InChI=1S/C24H33N3O2/c1-29-22-10-8-19(9-11-22)23-24(28)20(17-26-12-4-2-5-13-26)16-21(25-23)18-27-14-6-3-7-15-27/h8-11,16,28H,2-7,12-15,17-18H2,1H3/p+1