1,3,5-trimethyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]pyrazole-4-carboxamide

Systemtic Name: 1,3,5-trimethyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]pyrazole-4-carboxamide Openeye Name: 1,3,5-trimethyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]pyrazole-4-carboxamide CAS Name: 1,3,5-trimethyl-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-4-pyrazolecarboxamide IUPAC Name: 1,3,5-trimethyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]pyrazole-4-carboxamide Traditional Name: 1,3,5-trimethyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]pyrazole-4-carboxamide Formula: C17H24N5O2+ MolecularWeight: 330.40476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C(=O)NCC2=C[NH+]=C(C=C2)N3CCOCC3

Isomeric SMILES

CC1=C(C(=NN1C)C)C(=O)NCC2=C[NH+]=C(C=C2)N3CCOCC3

InChI

InChI=1S/C17H23N5O2/c1-12-16(13(2)21(3)20-12)17(23)19-11-14-4-5-15(18-10-14)22-6-8-24-9-7-22/h4-5,10H,6-9,11H2,1-3H3,(H,19,23)/p+1