(7R)-7-methyl-1-(1-oxidanidylpyridin-1-ium-2-yl)sulfonyl-azepan-3-one

Systemtic Name: (7R)-7-methyl-1-(1-oxidanidylpyridin-1-ium-2-yl)sulfonyl-azepan-3-one Openeye Name: (7R)-7-methyl-1-(1-oxidopyridin-1-ium-2-yl)sulfonyl-azepan-3-one CAS Name: (7R)-7-methyl-1-[(1-oxido-2-pyridin-1-iumyl)sulfonyl]-3-azepanone IUPAC Name: (7R)-7-methyl-1-(1-oxidopyridin-1-ium-2-yl)sulfonylazepan-3-one Traditional Name: (7R)-7-methyl-1-(1-oxidopyridin-1-ium-2-yl)sulfonyl-azepan-3-one Formula: C12H16N2O4S MolecularWeight: 284.33144

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(=O)CN1S(=O)(=O)C2=CC=CC=[N+]2[O-]

Isomeric SMILES

C[C@@H]1CCCC(=O)CN1S(=O)(=O)C2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C12H16N2O4S/c1-10-5-4-6-11(15)9-14(10)19(17,18)12-7-2-3-8-13(12)16/h2-3,7-8,10H,4-6,9H2,1H3/t10-/m1/s1