5-[1-(cyclopropylmethyl)pyridin-1-ium-4-yl]-3-methyl-1,2-oxazole bromide

Systemtic Name: 5-[1-(cyclopropylmethyl)pyridin-1-ium-4-yl]-3-methyl-1,2-oxazole bromide Openeye Name: 5-[1-(cyclopropylmethyl)pyridin-1-ium-4-yl]-3-methyl-isoxazole bromide CAS Name: 5-[1-(cyclopropylmethyl)-4-pyridin-1-iumyl]-3-methylisoxazole bromide IUPAC Name: 5-[1-(cyclopropylmethyl)pyridin-1-ium-4-yl]-3-methyl-1,2-oxazole bromide Traditional Name: 5-[1-(cyclopropylmethyl)pyridin-1-ium-4-yl]-3-methyl-isoxazole bromide Formula: C13H15BrN2O MolecularWeight: 295.175

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)C2=CC=[N+](C=C2)CC3CC3.[Br-]

Isomeric SMILES

CC1=NOC(=C1)C2=CC=[N+](C=C2)CC3CC3.[Br-]

InChI

InChI=1S/C13H15N2O.BrH/c1-10-8-13(16-14-10)12-4-6-15(7-5-12)9-11-2-3-11;/h4-8,11H,2-3,9H2,1H3;1H/q+1;/p-1