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

Systemtic Name: 2-chloranyl-5-(1-methyl-1,2,3,6-tetrahydropyridin-1-ium-5-yl)pyridine; (Z)-4-oxidanyl-4-oxidanylidene-but-2-enoate Openeye Name: 2-chloro-5-(1-methyl-1,2,3,6-tetrahydropyridin-1-ium-5-yl)pyridine; (Z)-4-hydroxy-4-oxo-but-2-enoate CAS Name: 2-chloro-5-(1-methyl-1,2,3,6-tetrahydropyridin-1-ium-5-yl)pyridine; (Z)-4-hydroxy-4-oxo-2-butenoate IUPAC Name: 2-chloro-5-(1-methyl-1,2,3,6-tetrahydropyridin-1-ium-5-yl)pyridine; (Z)-4-hydroxy-4-oxobut-2-enoate Traditional Name: 2-chloro-5-(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=CN=C(C=C2)Cl.C(=CC(=O)[O-])C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C11H13ClN2.C4H4O4/c1-14-6-2-3-10(8-14)9-4-5-11(12)13-7-9;5-3(6)1-2-4(7)8/h3-5,7H,2,6,8H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-