5-(2,2,6,6-tetramethyl-1,3-dihydropyridin-1-ium-4-yl)thiophene-2-carboxylate

Systemtic Name: 5-(2,2,6,6-tetramethyl-1,3-dihydropyridin-1-ium-4-yl)thiophene-2-carboxylate Openeye Name: 5-(2,2,6,6-tetramethyl-1,3-dihydropyridin-1-ium-4-yl)thiophene-2-carboxylate CAS Name: 5-(2,2,6,6-tetramethyl-1,3-dihydropyridin-1-ium-4-yl)-2-thiophenecarboxylate IUPAC Name: 5-(2,2,6,6-tetramethyl-1,3-dihydropyridin-1-ium-4-yl)thiophene-2-carboxylate Traditional Name: 5-(2,2,6,6-tetramethyl-1,3-dihydropyridin-1-ium-4-yl)-2-thenoate Formula: C14H19NO2S MolecularWeight: 265.37116

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC([NH2+]1)(C)C)C2=CC=C(S2)C(=O)[O-])C

Isomeric SMILES

CC1(CC(=CC([NH2+]1)(C)C)C2=CC=C(S2)C(=O)[O-])C

InChI

InChI=1S/C14H19NO2S/c1-13(2)7-9(8-14(3,4)15-13)10-5-6-11(18-10)12(16)17/h5-7,15H,8H2,1-4H3,(H,16,17)