5-[(4-chloranylpyrazol-1-yl)methyl]-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)furan-2-carboxamide

Systemtic Name: 5-[(4-chloranylpyrazol-1-yl)methyl]-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)furan-2-carboxamide Openeye Name: 5-[(4-chloropyrazol-1-yl)methyl]-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)furan-2-carboxamide CAS Name: 5-[(4-chloro-1-pyrazolyl)methyl]-N-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)-2-furancarboxamide IUPAC Name: 5-[(4-chloropyrazol-1-yl)methyl]-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)furan-2-carboxamide Traditional Name: 5-[(4-chloropyrazol-1-yl)methyl]-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-2-furamide Formula: C18H26ClN4O2+ MolecularWeight: 365.87764

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)NC(=O)C2=CC=C(O2)CN3C=C(C=N3)Cl)C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)NC(=O)C2=CC=C(O2)CN3C=C(C=N3)Cl)C

InChI

InChI=1S/C18H25ClN4O2/c1-17(2)7-13(8-18(3,4)22-17)21-16(24)15-6-5-14(25-15)11-23-10-12(19)9-20-23/h5-6,9-10,13,22H,7-8,11H2,1-4H3,(H,21,24)/p+1