3-methyl-1,2,3,6-tetrahydropyridin-1-ium-5-carboxylic acid bromide

Systemtic Name: 3-methyl-1,2,3,6-tetrahydropyridin-1-ium-5-carboxylic acid bromide Openeye Name: 3-methyl-1,2,3,6-tetrahydropyridin-1-ium-5-carboxylic acid bromide CAS Name: 3-methyl-1,2,3,6-tetrahydropyridin-1-ium-5-carboxylic acid bromide IUPAC Name: 3-methyl-1,2,3,6-tetrahydropyridin-1-ium-5-carboxylic acid bromide Traditional Name: 3-methyl-1,2,3,6-tetrahydropyridin-1-ium-5-carboxylic acid bromide Formula: C7H12BrNO2 MolecularWeight: 222.07968

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH2+]CC(=C1)C(=O)O.[Br-]

Isomeric SMILES

CC1C[NH2+]CC(=C1)C(=O)O.[Br-]

InChI

InChI=1S/C7H11NO2.BrH/c1-5-2-6(7(9)10)4-8-3-5;/h2,5,8H,3-4H2,1H3,(H,9,10);1H