1-(3,4-dihydro-1,2-benzodioxin-7-yl)-2-(1,3-thiazol-3-ium-3-yl)ethanone

Systemtic Name: 1-(3,4-dihydro-1,2-benzodioxin-7-yl)-2-(1,3-thiazol-3-ium-3-yl)ethanone Openeye Name: 1-(3,4-dihydro-1,2-benzodioxin-7-yl)-2-thiazol-3-ium-3-yl-ethanone CAS Name: 1-(3,4-dihydro-1,2-benzodioxin-7-yl)-2-(3-thiazol-3-iumyl)ethanone IUPAC Name: 1-(3,4-dihydro-1,2-benzodioxin-7-yl)-2-(1,3-thiazol-3-ium-3-yl)ethanone Traditional Name: 1-(3,4-dihydro-1,2-benzodioxin-7-yl)-2-thiazol-3-ium-3-yl-ethanone Formula: C13H12NO3S+ MolecularWeight: 262.30428

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Descriptors Computed from Structure

Canonical SMILES:

C1COOC2=C1C=CC(=C2)C(=O)C[N+]3=CSC=C3

Isomeric SMILES

C1COOC2=C1C=CC(=C2)C(=O)C[N+]3=CSC=C3

InChI

InChI=1S/C13H12NO3S/c15-12(8-14-4-6-18-9-14)11-2-1-10-3-5-16-17-13(10)7-11/h1-2,4,6-7,9H,3,5,8H2/q+1