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

Systemtic Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-propan-1-one Openeye Name: 1-indan-5-yl-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-propan-1-one CAS Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-[(1-oxido-2-pyridin-1-iumyl)thio]-1-propanone IUPAC Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylpropan-1-one Traditional Name: 1-indan-5-yl-2-[(1-oxidopyridin-1-ium-2-yl)thio]propan-1-one Formula: C17H17NO2S MolecularWeight: 299.38738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC2=C(CCC2)C=C1)SC3=CC=CC=[N+]3[O-]

Isomeric SMILES

CC(C(=O)C1=CC2=C(CCC2)C=C1)SC3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C17H17NO2S/c1-12(21-16-7-2-3-10-18(16)20)17(19)15-9-8-13-5-4-6-14(13)11-15/h2-3,7-12H,4-6H2,1H3