2-chloranyl-6-(1-methyl-1,2,3,6-tetrahydropyridin-1-ium-5-yl)pyridine; (Z)-4-oxidanyl-4-oxidanylidene-but-2-enoate

Systemtic Name: 2-chloranyl-6-(1-methyl-1,2,3,6-tetrahydropyridin-1-ium-5-yl)pyridine; (Z)-4-oxidanyl-4-oxidanylidene-but-2-enoate Openeye Name: 2-chloro-6-(1-methyl-1,2,3,6-tetrahydropyridin-1-ium-5-yl)pyridine; (Z)-4-hydroxy-4-oxo-but-2-enoate CAS Name: 2-chloro-6-(1-methyl-1,2,3,6-tetrahydropyridin-1-ium-5-yl)pyridine; (Z)-4-hydroxy-4-oxo-2-butenoate IUPAC Name: 2-chloro-6-(1-methyl-1,2,3,6-tetrahydropyridin-1-ium-5-yl)pyridine; (Z)-4-hydroxy-4-oxobut-2-enoate Traditional Name: 2-chloro-6-(1-methyl-1,2,3,6-tetrahydropyridin-1-ium-5-yl)pyridine; (Z)-4-hydroxy-4-keto-but-2-enoate Formula: C15H17ClN2O4 MolecularWeight: 324.75948

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC=C(C1)C2=NC(=CC=C2)Cl.C(=CC(=O)[O-])C(=O)O

Isomeric SMILES

C[NH+]1CCC=C(C1)C2=NC(=CC=C2)Cl.C(=C\C(=O)[O-])\C(=O)O

InChI

InChI=1S/C11H13ClN2.C4H4O4/c1-14-7-3-4-9(8-14)10-5-2-6-11(12)13-10;5-3(6)1-2-4(7)8/h2,4-6H,3,7-8H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-