(2S)-2-(2-ethoxyphenyl)-2-piperidin-1-ium-1-yl-ethanethioamide

Systemtic Name: (2S)-2-(2-ethoxyphenyl)-2-piperidin-1-ium-1-yl-ethanethioamide Openeye Name: (2S)-2-(2-ethoxyphenyl)-2-piperidin-1-ium-1-yl-thioacetamide CAS Name: (2S)-2-(2-ethoxyphenyl)-2-(1-piperidin-1-iumyl)ethanethioamide IUPAC Name: (2S)-2-(2-ethoxyphenyl)-2-piperidin-1-ium-1-ylethanethioamide Traditional Name: (2S)-2-o-phenetyl-2-piperidin-1-ium-1-yl-thioacetamide Formula: C15H23N2OS+ MolecularWeight: 279.42092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(C(=S)N)[NH+]2CCCCC2

Isomeric SMILES

CCOC1=CC=CC=C1[C@@H](C(=S)N)[NH+]2CCCCC2

InChI

InChI=1S/C15H22N2OS/c1-2-18-13-9-5-4-8-12(13)14(15(16)19)17-10-6-3-7-11-17/h4-5,8-9,14H,2-3,6-7,10-11H2,1H3,(H2,16,19)/p+1/t14-/m0/s1