6-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 6-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridin-1-ium-3-carboxamide Openeye Name: 6-morpholino-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridin-1-ium-3-carboxamide CAS Name: 6-(4-morpholinyl)-N-[(1,3,5-trimethyl-4-pyrazolyl)methyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 6-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridin-1-ium-3-carboxamide Traditional Name: 6-morpholino-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridin-1-ium-3-carboxamide Formula: C17H24N5O2+ MolecularWeight: 330.40476

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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