5-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium-2-carboxylate

Systemtic Name: 5-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium-2-carboxylate Openeye Name: 5-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium-2-carboxylate CAS Name: 5-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium-2-carboxylate IUPAC Name: 5-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium-2-carboxylate Traditional Name: 5-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium-2-carboxylate Formula: C9H11NO2S MolecularWeight: 197.25414

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC2=C(C1)C=C(S2)C(=O)[O-]

Isomeric SMILES

C[NH+]1CCC2=C(C1)C=C(S2)C(=O)[O-]

InChI

InChI=1S/C9H11NO2S/c1-10-3-2-7-6(5-10)4-8(13-7)9(11)12/h4H,2-3,5H2,1H3,(H,11,12)