N-(6-chloranyl-1,3-benzothiazol-2-yl)piperidin-1-ium-4-carboxamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)piperidin-1-ium-4-carboxamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)piperidin-1-ium-4-carboxamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)piperidin-1-ium-4-carboxamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)piperidin-1-ium-4-carboxamide Formula: C13H15ClN3OS+ MolecularWeight: 296.7957

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1C(=O)NC2=NC3=C(S2)C=C(C=C3)Cl

Isomeric SMILES

C1C[NH2+]CCC1C(=O)NC2=NC3=C(S2)C=C(C=C3)Cl

InChI

InChI=1S/C13H14ClN3OS/c14-9-1-2-10-11(7-9)19-13(16-10)17-12(18)8-3-5-15-6-4-8/h1-2,7-8,15H,3-6H2,(H,16,17,18)/p+1