N-[(3S)-1-azoniabicyclo[2.2.2]octan-3-yl]-1,3-benzothiazol-2-amine

Systemtic Name: N-[(3S)-1-azoniabicyclo[2.2.2]octan-3-yl]-1,3-benzothiazol-2-amine Openeye Name: N-[(3S)-quinuclidin-1-ium-3-yl]-1,3-benzothiazol-2-amine CAS Name: N-[(3S)-1-azoniabicyclo[2.2.2]octan-3-yl]-1,3-benzothiazol-2-amine IUPAC Name: N-[(3S)-1-azoniabicyclo[2.2.2]octan-3-yl]-1,3-benzothiazol-2-amine Traditional Name: 1,3-benzothiazol-2-yl-[(3S)-quinuclidin-1-ium-3-yl]amine Formula: C14H18N3S+ MolecularWeight: 260.37782

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2CCC1C(C2)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1C[NH+]2CCC1[C@@H](C2)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C14H17N3S/c1-2-4-13-11(3-1)15-14(18-13)16-12-9-17-7-5-10(12)6-8-17/h1-4,10,12H,5-9H2,(H,15,16)/p+1/t12-/m1/s1