N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-ethyl-6-methyl-4-oxidanylidene-1-(2-piperidin-1-ium-1-ylethyl)pyridine-3-carboxamide

Systemtic Name: N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-ethyl-6-methyl-4-oxidanylidene-1-(2-piperidin-1-ium-1-ylethyl)pyridine-3-carboxamide Openeye Name: N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-ethyl-6-methyl-4-oxo-1-(2-piperidin-1-ium-1-ylethyl)pyridine-3-carboxamide CAS Name: N-[(1,5-dimethyl-4-pyrazolyl)methyl]-2-ethyl-6-methyl-4-oxo-1-[2-(1-piperidin-1-iumyl)ethyl]-3-pyridinecarboxamide IUPAC Name: N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-ethyl-6-methyl-4-oxo-1-(2-piperidin-1-ium-1-ylethyl)pyridine-3-carboxamide Traditional Name: N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-ethyl-4-keto-6-methyl-1-(2-piperidin-1-ium-1-ylethyl)nicotinamide Formula: C22H34N5O2+ MolecularWeight: 400.53766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)C=C(N1CC[NH+]2CCCCC2)C)C(=O)NCC3=C(N(N=C3)C)C

Isomeric SMILES

CCC1=C(C(=O)C=C(N1CC[NH+]2CCCCC2)C)C(=O)NCC3=C(N(N=C3)C)C

InChI

InChI=1S/C22H33N5O2/c1-5-19-21(22(29)23-14-18-15-24-25(4)17(18)3)20(28)13-16(2)27(19)12-11-26-9-7-6-8-10-26/h13,15H,5-12,14H2,1-4H3,(H,23,29)/p+1