N-[(2-methylphenyl)methyl]-2-pyrrolidin-1-yl-pyridin-1-ium-3-carboxamide

Systemtic Name: N-[(2-methylphenyl)methyl]-2-pyrrolidin-1-yl-pyridin-1-ium-3-carboxamide Openeye Name: N-(o-tolylmethyl)-2-pyrrolidin-1-yl-pyridin-1-ium-3-carboxamide CAS Name: N-[(2-methylphenyl)methyl]-2-(1-pyrrolidinyl)-3-pyridin-1-iumcarboxamide IUPAC Name: N-[(2-methylphenyl)methyl]-2-pyrrolidin-1-ylpyridin-1-ium-3-carboxamide Traditional Name: N-(2-methylbenzyl)-2-pyrrolidino-pyridin-1-ium-3-carboxamide Formula: C18H22N3O+ MolecularWeight: 296.38678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)C2=C([NH+]=CC=C2)N3CCCC3

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)C2=C([NH+]=CC=C2)N3CCCC3

InChI

InChI=1S/C18H21N3O/c1-14-7-2-3-8-15(14)13-20-18(22)16-9-6-10-19-17(16)21-11-4-5-12-21/h2-3,6-10H,4-5,11-13H2,1H3,(H,20,22)/p+1