4-chloranyl-N-(pyridin-2-ylmethyl)-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzamide

Systemtic Name: 4-chloranyl-N-(pyridin-2-ylmethyl)-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzamide Openeye Name: 4-chloro-N-(2-pyridylmethyl)-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzamide CAS Name: 4-chloro-N-(2-pyridinylmethyl)-N-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)benzamide IUPAC Name: 4-chloro-N-(pyridin-2-ylmethyl)-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzamide Traditional Name: 4-chloro-N-(2-pyridylmethyl)-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzamide Formula: C22H29ClN3O+ MolecularWeight: 386.93816

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)N(CC2=CC=CC=N2)C(=O)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)N(CC2=CC=CC=N2)C(=O)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C22H28ClN3O/c1-21(2)13-19(14-22(3,4)25-21)26(15-18-7-5-6-12-24-18)20(27)16-8-10-17(23)11-9-16/h5-12,19,25H,13-15H2,1-4H3/p+1