3-(phenylsulfonyl)-4-(pyridin-3-ylmethoxy)-2,3-dihydro-1-benzothiophene 1,1-dioxide

Systemtic Name: 3-(phenylsulfonyl)-4-(pyridin-3-ylmethoxy)-2,3-dihydro-1-benzothiophene 1,1-dioxide Openeye Name: 3-(benzenesulfonyl)-4-(3-pyridylmethoxy)-2,3-dihydrobenzothiophene 1,1-dioxide CAS Name: 3-(benzenesulfonyl)-4-(3-pyridinylmethoxy)-2,3-dihydro-1-benzothiophene 1,1-dioxide IUPAC Name: 3-(benzenesulfonyl)-4-(pyridin-3-ylmethoxy)-2,3-dihydro-1-benzothiophene 1,1-dioxide Traditional Name: 3-besyl-4-(3-pyridylmethoxy)-2,3-dihydrobenzothiophene 1,1-dioxide Formula: C20H17NO5S2 MolecularWeight: 415.48268

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(C=CC=C2S1(=O)=O)OCC3=CN=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1C(C2=C(C=CC=C2S1(=O)=O)OCC3=CN=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H17NO5S2/c22-27(23)14-19(28(24,25)16-7-2-1-3-8-16)20-17(9-4-10-18(20)27)26-13-15-6-5-11-21-12-15/h1-12,19H,13-14H2