3-phenyl-N-pyridin-1-ium-4-yl-butanamide

Systemtic Name: 3-phenyl-N-pyridin-1-ium-4-yl-butanamide Openeye Name: 3-phenyl-N-pyridin-1-ium-4-yl-butanamide CAS Name: 3-phenyl-N-(4-pyridin-1-iumyl)butanamide IUPAC Name: 3-phenyl-N-pyridin-1-ium-4-ylbutanamide Traditional Name: 3-phenyl-N-pyridin-1-ium-4-yl-butyramide Formula: C15H17N2O+ MolecularWeight: 241.30828

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=CC=[NH+]C=C1)C2=CC=CC=C2

Isomeric SMILES

CC(CC(=O)NC1=CC=[NH+]C=C1)C2=CC=CC=C2

InChI

InChI=1S/C15H16N2O/c1-12(13-5-3-2-4-6-13)11-15(18)17-14-7-9-16-10-8-14/h2-10,12H,11H2,1H3,(H,16,17,18)/p+1