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

Systemtic Name: 2-[4-[2-(4-ethoxyphenyl)ethyl]piperidin-1-ium-1-yl]-N-(1,3-thiazol-2-yl)ethanamide Openeye Name: 2-[4-[2-(4-ethoxyphenyl)ethyl]piperidin-1-ium-1-yl]-N-thiazol-2-yl-acetamide CAS Name: 2-[4-[2-(4-ethoxyphenyl)ethyl]-1-piperidin-1-iumyl]-N-(2-thiazolyl)acetamide IUPAC Name: 2-[4-[2-(4-ethoxyphenyl)ethyl]piperidin-1-ium-1-yl]-N-(1,3-thiazol-2-yl)acetamide Traditional Name: 2-[4-(2-p-phenetylethyl)piperidin-1-ium-1-yl]-N-thiazol-2-yl-acetamide Formula: C20H28N3O2S+ MolecularWeight: 374.52022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CCC2CC[NH+](CC2)CC(=O)NC3=NC=CS3

Isomeric SMILES

CCOC1=CC=C(C=C1)CCC2CC[NH+](CC2)CC(=O)NC3=NC=CS3

InChI

InChI=1S/C20H27N3O2S/c1-2-25-18-7-5-16(6-8-18)3-4-17-9-12-23(13-10-17)15-19(24)22-20-21-11-14-26-20/h5-8,11,14,17H,2-4,9-10,12-13,15H2,1H3,(H,21,22,24)/p+1