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

Systemtic Name: (3R)-1-[[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl]piperidin-1-ium-3-carboxamide Openeye Name: (3R)-1-[[2-(4-chlorophenyl)thiazol-4-yl]methyl]piperidin-1-ium-3-carboxamide CAS Name: (3R)-1-[[2-(4-chlorophenyl)-4-thiazolyl]methyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-1-[[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl]piperidin-1-ium-3-carboxamide Traditional Name: (3R)-1-[[2-(4-chlorophenyl)thiazol-4-yl]methyl]piperidin-1-ium-3-carboxamide Formula: C16H19ClN3OS+ MolecularWeight: 336.85956

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CSC(=N2)C3=CC=C(C=C3)Cl)C(=O)N

Isomeric SMILES

C1C[C@H](C[NH+](C1)CC2=CSC(=N2)C3=CC=C(C=C3)Cl)C(=O)N

InChI

InChI=1S/C16H18ClN3OS/c17-13-5-3-11(4-6-13)16-19-14(10-22-16)9-20-7-1-2-12(8-20)15(18)21/h3-6,10,12H,1-2,7-9H2,(H2,18,21)/p+1/t12-/m1/s1