3-phenyl-N-(pyridin-1-ium-2-ylmethyl)propanamide

Systemtic Name: 3-phenyl-N-(pyridin-1-ium-2-ylmethyl)propanamide Openeye Name: 3-phenyl-N-(pyridin-1-ium-2-ylmethyl)propanamide CAS Name: 3-phenyl-N-(2-pyridin-1-iumylmethyl)propanamide IUPAC Name: 3-phenyl-N-(pyridin-1-ium-2-ylmethyl)propanamide Traditional Name: 3-phenyl-N-(pyridin-1-ium-2-ylmethyl)propionamide Formula: C15H17N2O+ MolecularWeight: 241.30828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)NCC2=CC=CC=[NH+]2

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)NCC2=CC=CC=[NH+]2

InChI

InChI=1S/C15H16N2O/c18-15(10-9-13-6-2-1-3-7-13)17-12-14-8-4-5-11-16-14/h1-8,11H,9-10,12H2,(H,17,18)/p+1