1-[[2-(4-ethoxy-3-methoxy-phenyl)-1,3-thiazol-4-yl]methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[[2-(4-ethoxy-3-methoxy-phenyl)-1,3-thiazol-4-yl]methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[[2-(4-ethoxy-3-methoxy-phenyl)thiazol-4-yl]methyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[[2-(4-ethoxy-3-methoxyphenyl)-4-thiazolyl]methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[[2-(4-ethoxy-3-methoxyphenyl)-1,3-thiazol-4-yl]methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[[2-(4-ethoxy-3-methoxy-phenyl)thiazol-4-yl]methyl]piperidin-1-ium-4-carboxamide Formula: C19H26N3O3S+ MolecularWeight: 376.49304

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NC(=CS2)C[NH+]3CCC(CC3)C(=O)N)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NC(=CS2)C[NH+]3CCC(CC3)C(=O)N)OC

InChI

InChI=1S/C19H25N3O3S/c1-3-25-16-5-4-14(10-17(16)24-2)19-21-15(12-26-19)11-22-8-6-13(7-9-22)18(20)23/h4-5,10,12-13H,3,6-9,11H2,1-2H3,(H2,20,23)/p+1