1-(2,3-dihydro-1H-inden-5-yl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanone Openeye Name: 1-indan-5-yl-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-ethanone CAS Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-[(1-oxido-2-pyridin-1-iumyl)thio]ethanone IUPAC Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylethanone Traditional Name: 1-indan-5-yl-2-[(1-oxidopyridin-1-ium-2-yl)thio]ethanone Formula: C16H15NO2S MolecularWeight: 285.3608

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)C(=O)CSC3=CC=CC=[N+]3[O-]

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)C(=O)CSC3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C16H15NO2S/c18-15(11-20-16-6-1-2-9-17(16)19)14-8-7-12-4-3-5-13(12)10-14/h1-2,6-10H,3-5,11H2