(3S)-N-(6-chloranyl-1,3-benzothiazol-2-yl)piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-N-(6-chloranyl-1,3-benzothiazol-2-yl)piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-(6-chloro-1,3-benzothiazol-2-yl)piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-(6-chloro-1,3-benzothiazol-2-yl)-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-(6-chloro-1,3-benzothiazol-2-yl)piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-(6-chloro-1,3-benzothiazol-2-yl)piperidin-1-ium-3-carboxamide Formula: C13H15ClN3OS+ MolecularWeight: 296.7957

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH2+]C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)Cl

Isomeric SMILES

C1C[C@@H](C[NH2+]C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)Cl

InChI

InChI=1S/C13H14ClN3OS/c14-9-3-4-10-11(6-9)19-13(16-10)17-12(18)8-2-1-5-15-7-8/h3-4,6,8,15H,1-2,5,7H2,(H,16,17,18)/p+1/t8-/m0/s1