2-[(2S,4R)-4-methoxypyrrolidin-1-ium-2-yl]-1,3-benzothiazole

Systemtic Name: 2-[(2S,4R)-4-methoxypyrrolidin-1-ium-2-yl]-1,3-benzothiazole Openeye Name: 2-[(2S,4R)-4-methoxypyrrolidin-1-ium-2-yl]-1,3-benzothiazole CAS Name: 2-[(2S,4R)-4-methoxy-2-pyrrolidin-1-iumyl]-1,3-benzothiazole IUPAC Name: 2-[(2S,4R)-4-methoxypyrrolidin-1-ium-2-yl]-1,3-benzothiazole Traditional Name: 2-[(2S,4R)-4-methoxypyrrolidin-1-ium-2-yl]-1,3-benzothiazole Formula: C12H15N2OS+ MolecularWeight: 235.3253

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC([NH2+]C1)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CO[C@@H]1C[C@H]([NH2+]C1)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C12H14N2OS/c1-15-8-6-10(13-7-8)12-14-9-4-2-3-5-11(9)16-12/h2-5,8,10,13H,6-7H2,1H3/p+1/t8-,10+/m1/s1