2-(1,3-benzothiazol-3-ium-3-yl)propanamide tetrafluoroborate

Systemtic Name: 2-(1,3-benzothiazol-3-ium-3-yl)propanamide tetrafluoroborate Openeye Name: 2-(1,3-benzothiazol-3-ium-3-yl)propanamide tetrafluoroborate CAS Name: 2-(1,3-benzothiazol-3-ium-3-yl)propanamide tetrafluoroborate IUPAC Name: 2-(1,3-benzothiazol-3-ium-3-yl)propanamide tetrafluoroborate Traditional Name: 2-(1,3-benzothiazol-3-ium-3-yl)propionamide tetrafluoroborate Formula: C10H11BF4N2OS MolecularWeight: 294.076753

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC(C(=O)N)[N+]1=CSC2=CC=CC=C21

Isomeric SMILES

[B-](F)(F)(F)F.CC(C(=O)N)[N+]1=CSC2=CC=CC=C21

InChI

InChI=1S/C10H10N2OS.BF4/c1-7(10(11)13)12-6-14-9-5-3-2-4-8(9)12;2-1(3,4)5/h2-7H,1H3,(H-,11,13);/q;-1/p+1