1-[2-(3-methylphenoxy)ethyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-[2-(3-methylphenoxy)ethyl]pyridin-1-ium-3-carboxamide Openeye Name: 1-[2-(3-methylphenoxy)ethyl]pyridin-1-ium-3-carboxamide CAS Name: 1-[2-(3-methylphenoxy)ethyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[2-(3-methylphenoxy)ethyl]pyridin-1-ium-3-carboxamide Traditional Name: 1-[2-(3-methylphenoxy)ethyl]pyridin-1-ium-3-carboxamide Formula: C15H17N2O2+ MolecularWeight: 257.30768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC[N+]2=CC=CC(=C2)C(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)OCC[N+]2=CC=CC(=C2)C(=O)N

InChI

InChI=1S/C15H16N2O2/c1-12-4-2-6-14(10-12)19-9-8-17-7-3-5-13(11-17)15(16)18/h2-7,10-11H,8-9H2,1H3,(H-,16,18)/p+1