2-[2-[(3S)-3-oxidanylpiperidin-1-ium-1-yl]ethanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-[(3S)-3-oxidanylpiperidin-1-ium-1-yl]ethanoylamino]thiophene-3-carboxamide Openeye Name: 2-[[2-[(3S)-3-hydroxypiperidin-1-ium-1-yl]acetyl]amino]thiophene-3-carboxamide CAS Name: 2-[[2-[(3S)-3-hydroxy-1-piperidin-1-iumyl]-1-oxoethyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[2-[(3S)-3-hydroxypiperidin-1-ium-1-yl]acetyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[2-[(3S)-3-hydroxypiperidin-1-ium-1-yl]acetyl]amino]thiophene-3-carboxamide Formula: C12H18N3O3S+ MolecularWeight: 284.35462

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC(=O)NC2=C(C=CS2)C(=O)N)O

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC(=O)NC2=C(C=CS2)C(=O)N)O

InChI

InChI=1S/C12H17N3O3S/c13-11(18)9-3-5-19-12(9)14-10(17)7-15-4-1-2-8(16)6-15/h3,5,8,16H,1-2,4,6-7H2,(H2,13,18)(H,14,17)/p+1/t8-/m0/s1