(3S)-3-(azepan-1-ium-1-yl)-2,3-dihydrothiophene 1,1-dioxide

Systemtic Name: (3S)-3-(azepan-1-ium-1-yl)-2,3-dihydrothiophene 1,1-dioxide Openeye Name: (3S)-3-(azepan-1-ium-1-yl)-2,3-dihydrothiophene 1,1-dioxide CAS Name: (3S)-3-(1-azepan-1-iumyl)-2,3-dihydrothiophene 1,1-dioxide IUPAC Name: (3S)-3-(azepan-1-ium-1-yl)-2,3-dihydrothiophene 1,1-dioxide Traditional Name: (3S)-3-(azepan-1-ium-1-yl)-2,3-dihydrothiophene 1,1-dioxide Formula: C10H18NO2S+ MolecularWeight: 216.32042

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)C2CS(=O)(=O)C=C2

Isomeric SMILES

C1CCC[NH+](CC1)[C@@H]2CS(=O)(=O)C=C2

InChI

InChI=1S/C10H17NO2S/c12-14(13)8-5-10(9-14)11-6-3-1-2-4-7-11/h5,8,10H,1-4,6-7,9H2/p+1/t10-/m0/s1