N-(3-pyridin-1-ium-1-ylpropyl)methanamide bromide

Systemtic Name: N-(3-pyridin-1-ium-1-ylpropyl)methanamide bromide Openeye Name: N-(3-pyridin-1-ium-1-ylpropyl)formamide bromide CAS Name: N-[3-(1-pyridin-1-iumyl)propyl]formamide bromide IUPAC Name: N-(3-pyridin-1-ium-1-ylpropyl)formamide bromide Traditional Name: N-(3-pyridin-1-ium-1-ylpropyl)formamide bromide Formula: C9H13BrN2O MolecularWeight: 245.11632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CCCNC=O.[Br-]

Isomeric SMILES

C1=CC=[N+](C=C1)CCCNC=O.[Br-]

InChI

InChI=1S/C9H12N2O.BrH/c12-9-10-5-4-8-11-6-2-1-3-7-11;/h1-3,6-7,9H,4-5,8H2;1H