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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH+]2CCC(CC2)C(=O)NCC3=CC=NC=C3

Isomeric SMILES

CC1=CC(=CC=C1)C[NH+]2CCC(CC2)C(=O)NCC3=CC=NC=C3

InChI

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