3-(phenylsulfonyl)-4-(2-pyrrol-1-ylethoxy)-2,3-dihydro-1-benzothiophene 1,1-dioxide

Systemtic Name: 3-(phenylsulfonyl)-4-(2-pyrrol-1-ylethoxy)-2,3-dihydro-1-benzothiophene 1,1-dioxide Openeye Name: 3-(benzenesulfonyl)-4-(2-pyrrol-1-ylethoxy)-2,3-dihydrobenzothiophene 1,1-dioxide CAS Name: 3-(benzenesulfonyl)-4-[2-(1-pyrrolyl)ethoxy]-2,3-dihydro-1-benzothiophene 1,1-dioxide IUPAC Name: 3-(benzenesulfonyl)-4-(2-pyrrol-1-ylethoxy)-2,3-dihydro-1-benzothiophene 1,1-dioxide Traditional Name: 3-besyl-4-(2-pyrrol-1-ylethoxy)-2,3-dihydrobenzothiophene 1,1-dioxide Formula: C20H19NO5S2 MolecularWeight: 417.49856

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(C=CC=C2S1(=O)=O)OCCN3C=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1C(C2=C(C=CC=C2S1(=O)=O)OCCN3C=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H19NO5S2/c22-27(23)15-19(28(24,25)16-7-2-1-3-8-16)20-17(9-6-10-18(20)27)26-14-13-21-11-4-5-12-21/h1-12,19H,13-15H2