(2R)-N-(6-chloranyl-1,3-benzothiazol-2-yl)pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2R)-N-(6-chloranyl-1,3-benzothiazol-2-yl)pyrrolidin-1-ium-2-carboxamide Openeye Name: (2R)-N-(6-chloro-1,3-benzothiazol-2-yl)pyrrolidin-1-ium-2-carboxamide CAS Name: (2R)-N-(6-chloro-1,3-benzothiazol-2-yl)-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2R)-N-(6-chloro-1,3-benzothiazol-2-yl)pyrrolidin-1-ium-2-carboxamide Traditional Name: (2R)-N-(6-chloro-1,3-benzothiazol-2-yl)pyrrolidin-1-ium-2-carboxamide Formula: C12H13ClN3OS+ MolecularWeight: 282.76912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12ClN3OS/c13-7-3-4-8-10(6-7)18-12(15-8)16-11(17)9-2-1-5-14-9/h3-4,6,9,14H,1-2,5H2,(H,15,16,17)/p+1/t9-/m1/s1