2-(2,3-dimethylphenoxy)-N-[4-(piperidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]ethanamide

Systemtic Name: 2-(2,3-dimethylphenoxy)-N-[4-(piperidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]ethanamide Openeye Name: 2-(2,3-dimethylphenoxy)-N-[4-(piperidin-1-ium-1-ylmethyl)thiazol-2-yl]acetamide CAS Name: 2-(2,3-dimethylphenoxy)-N-[4-(1-piperidin-1-iumylmethyl)-2-thiazolyl]acetamide IUPAC Name: 2-(2,3-dimethylphenoxy)-N-[4-(piperidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]acetamide Traditional Name: 2-(2,3-dimethylphenoxy)-N-[4-(piperidin-1-ium-1-ylmethyl)thiazol-2-yl]acetamide Formula: C19H26N3O2S+ MolecularWeight: 360.49364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OCC(=O)NC2=NC(=CS2)C[NH+]3CCCCC3)C

Isomeric SMILES

CC1=C(C(=CC=C1)OCC(=O)NC2=NC(=CS2)C[NH+]3CCCCC3)C

InChI

InChI=1S/C19H25N3O2S/c1-14-7-6-8-17(15(14)2)24-12-18(23)21-19-20-16(13-25-19)11-22-9-4-3-5-10-22/h6-8,13H,3-5,9-12H2,1-2H3,(H,20,21,23)/p+1