2,4-dimethyl-3-phenethyl-pyridin-1-ium-1-carboxamide chloride

Systemtic Name: 2,4-dimethyl-3-phenethyl-pyridin-1-ium-1-carboxamide chloride Openeye Name: 2,4-dimethyl-3-phenethyl-pyridin-1-ium-1-carboxamide chloride CAS Name: 2,4-dimethyl-3-phenethyl-1-pyridin-1-iumcarboxamide chloride IUPAC Name: 2,4-dimethyl-3-phenethylpyridin-1-ium-1-carboxamide chloride Traditional Name: 2,4-dimethyl-3-phenethyl-pyridin-1-ium-1-carboxamide chloride Formula: C16H19ClN2O MolecularWeight: 290.78786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=[N+](C=C1)C(=O)N)C)CCC2=CC=CC=C2.[Cl-]

Isomeric SMILES

CC1=C(C(=[N+](C=C1)C(=O)N)C)CCC2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C16H18N2O.ClH/c1-12-10-11-18(16(17)19)13(2)15(12)9-8-14-6-4-3-5-7-14;/h3-7,10-11H,8-9H2,1-2H3,(H-,17,19);1H