N-(2,3-dihydro-1H-inden-5-yl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfonyl-ethanamide

Systemtic Name: N-(2,3-dihydro-1H-inden-5-yl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfonyl-ethanamide Openeye Name: N-indan-5-yl-2-(1-oxidopyridin-1-ium-2-yl)sulfonyl-acetamide CAS Name: N-(2,3-dihydro-1H-inden-5-yl)-2-[(1-oxido-2-pyridin-1-iumyl)sulfonyl]acetamide IUPAC Name: N-(2,3-dihydro-1H-inden-5-yl)-2-(1-oxidopyridin-1-ium-2-yl)sulfonylacetamide Traditional Name: N-indan-5-yl-2-(1-oxidopyridin-1-ium-2-yl)sulfonyl-acetamide Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)NC(=O)CS(=O)(=O)C3=CC=CC=[N+]3[O-]

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)NC(=O)CS(=O)(=O)C3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C16H16N2O4S/c19-15(11-23(21,22)16-6-1-2-9-18(16)20)17-14-8-7-12-4-3-5-13(12)10-14/h1-2,6-10H,3-5,11H2,(H,17,19)