N-(3-cyanothiophen-2-yl)-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-(3-cyanothiophen-2-yl)-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-(3-cyano-2-thienyl)-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-(3-cyano-2-thiophenyl)-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-(3-cyanothiophen-2-yl)-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-(3-cyano-2-thienyl)-2-piperidin-1-ium-1-yl-acetamide Formula: C12H16N3OS+ MolecularWeight: 250.33994

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(=O)NC2=C(C=CS2)C#N

Isomeric SMILES

C1CC[NH+](CC1)CC(=O)NC2=C(C=CS2)C#N

InChI

InChI=1S/C12H15N3OS/c13-8-10-4-7-17-12(10)14-11(16)9-15-5-2-1-3-6-15/h4,7H,1-3,5-6,9H2,(H,14,16)/p+1