6-(3,4-dimethoxyphenyl)-2-(2-piperidin-1-ium-1-ylethyl)pyridazin-3-one

Systemtic Name: 6-(3,4-dimethoxyphenyl)-2-(2-piperidin-1-ium-1-ylethyl)pyridazin-3-one Openeye Name: 6-(3,4-dimethoxyphenyl)-2-(2-piperidin-1-ium-1-ylethyl)pyridazin-3-one CAS Name: 6-(3,4-dimethoxyphenyl)-2-[2-(1-piperidin-1-iumyl)ethyl]-3-pyridazinone IUPAC Name: 6-(3,4-dimethoxyphenyl)-2-(2-piperidin-1-ium-1-ylethyl)pyridazin-3-one Traditional Name: 6-(3,4-dimethoxyphenyl)-2-(2-piperidin-1-ium-1-ylethyl)pyridazin-3-one Formula: C19H26N3O3+ MolecularWeight: 344.42804

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CC[NH+]3CCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CC[NH+]3CCCCC3)OC

InChI

InChI=1S/C19H25N3O3/c1-24-17-8-6-15(14-18(17)25-2)16-7-9-19(23)22(20-16)13-12-21-10-4-3-5-11-21/h6-9,14H,3-5,10-13H2,1-2H3/p+1