N-(5-methyl-1,2-oxazol-3-yl)-6-pyridin-1-ium-1-yl-hexanamide chloride

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-6-pyridin-1-ium-1-yl-hexanamide chloride Openeye Name: N-(5-methylisoxazol-3-yl)-6-pyridin-1-ium-1-yl-hexanamide chloride CAS Name: N-(5-methyl-3-isoxazolyl)-6-(1-pyridin-1-iumyl)hexanamide chloride IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-6-pyridin-1-ium-1-ylhexanamide chloride Traditional Name: N-(5-methylisoxazol-3-yl)-6-pyridin-1-ium-1-yl-hexanamide chloride Formula: C15H20ClN3O2 MolecularWeight: 309.7912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CCCCC[N+]2=CC=CC=C2.[Cl-]

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CCCCC[N+]2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C15H19N3O2.ClH/c1-13-12-14(17-20-13)16-15(19)8-4-2-5-9-18-10-6-3-7-11-18;/h3,6-7,10-12H,2,4-5,8-9H2,1H3;1H