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

Systemtic Name: 6-(4-ethylphenyl)-2-(2-piperidin-1-ium-1-ylethyl)pyridazin-3-one Openeye Name: 6-(4-ethylphenyl)-2-(2-piperidin-1-ium-1-ylethyl)pyridazin-3-one CAS Name: 6-(4-ethylphenyl)-2-[2-(1-piperidin-1-iumyl)ethyl]-3-pyridazinone IUPAC Name: 6-(4-ethylphenyl)-2-(2-piperidin-1-ium-1-ylethyl)pyridazin-3-one Traditional Name: 6-(4-ethylphenyl)-2-(2-piperidin-1-ium-1-ylethyl)pyridazin-3-one Formula: C19H26N3O+ MolecularWeight: 312.42924

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CC[NH+]3CCCCC3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CC[NH+]3CCCCC3

InChI

InChI=1S/C19H25N3O/c1-2-16-6-8-17(9-7-16)18-10-11-19(23)22(20-18)15-14-21-12-4-3-5-13-21/h6-11H,2-5,12-15H2,1H3/p+1