N-[(4-methylphenyl)methyl]-1-(pyridin-3-ylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: N-[(4-methylphenyl)methyl]-1-(pyridin-3-ylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: N-(p-tolylmethyl)-1-(3-pyridylmethyl)piperidin-1-ium-4-carboxamide CAS Name: N-[(4-methylphenyl)methyl]-1-(3-pyridinylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-[(4-methylphenyl)methyl]-1-(pyridin-3-ylmethyl)piperidin-1-ium-4-carboxamide Traditional Name: N-(4-methylbenzyl)-1-(3-pyridylmethyl)piperidin-1-ium-4-carboxamide Formula: C20H26N3O+ MolecularWeight: 324.43994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2CC[NH+](CC2)CC3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2CC[NH+](CC2)CC3=CN=CC=C3

InChI

InChI=1S/C20H25N3O/c1-16-4-6-17(7-5-16)14-22-20(24)19-8-11-23(12-9-19)15-18-3-2-10-21-13-18/h2-7,10,13,19H,8-9,11-12,14-15H2,1H3,(H,22,24)/p+1