N-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)-2-piperidin-1-ium-1-yl-acetamide Formula: C17H24N3OS+ MolecularWeight: 318.45696

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NC2=C(S1)C=C(C=C2)C)C(=O)C[NH+]3CCCCC3

Isomeric SMILES

CCN(C1=NC2=C(S1)C=C(C=C2)C)C(=O)C[NH+]3CCCCC3

InChI

InChI=1S/C17H23N3OS/c1-3-20(16(21)12-19-9-5-4-6-10-19)17-18-14-8-7-13(2)11-15(14)22-17/h7-8,11H,3-6,9-10,12H2,1-2H3/p+1