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

Systemtic Name: 1-[[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[[2-(2,3-dimethoxyphenyl)thiazol-4-yl]methyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[[2-(2,3-dimethoxyphenyl)-4-thiazolyl]methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[[2-(2,3-dimethoxyphenyl)thiazol-4-yl]methyl]piperidin-1-ium-4-carboxamide Formula: C18H24N3O3S+ MolecularWeight: 362.46646

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C2=NC(=CS2)C[NH+]3CCC(CC3)C(=O)N

Isomeric SMILES

COC1=CC=CC(=C1OC)C2=NC(=CS2)C[NH+]3CCC(CC3)C(=O)N

InChI

InChI=1S/C18H23N3O3S/c1-23-15-5-3-4-14(16(15)24-2)18-20-13(11-25-18)10-21-8-6-12(7-9-21)17(19)22/h3-5,11-12H,6-10H2,1-2H3,(H2,19,22)/p+1