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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C2=NC(=CS2)C[NH+]3CCCC(C3)C(=O)N

Isomeric SMILES

COC1=CC=CC(=C1OC)C2=NC(=CS2)C[NH+]3CCC[C@H](C3)C(=O)N

InChI

InChI=1S/C18H23N3O3S/c1-23-15-7-3-6-14(16(15)24-2)18-20-13(11-25-18)10-21-8-4-5-12(9-21)17(19)22/h3,6-7,11-12H,4-5,8-10H2,1-2H3,(H2,19,22)/p+1/t12-/m1/s1