ethyl 3-[4-methoxy-1,1-bis(oxidanylidene)-3-(phenylsulfonyl)-2,3-dihydro-1-benzothiophen-5-yl]propanoate

Systemtic Name: ethyl 3-[4-methoxy-1,1-bis(oxidanylidene)-3-(phenylsulfonyl)-2,3-dihydro-1-benzothiophen-5-yl]propanoate Openeye Name: ethyl 3-[3-(benzenesulfonyl)-4-methoxy-1,1-dioxo-2,3-dihydrobenzothiophen-5-yl]propanoate CAS Name: 3-[3-(benzenesulfonyl)-4-methoxy-1,1-dioxo-2,3-dihydro-1-benzothiophen-5-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[3-(benzenesulfonyl)-4-methoxy-1,1-dioxo-2,3-dihydro-1-benzothiophen-5-yl]propanoate Traditional Name: 3-(3-besyl-1,1-diketo-4-methoxy-2,3-dihydrobenzothiophen-5-yl)propionic acid ethyl ester Formula: C20H22O7S2 MolecularWeight: 438.51448

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=C(C2=C(C=C1)S(=O)(=O)CC2S(=O)(=O)C3=CC=CC=C3)OC

Isomeric SMILES

CCOC(=O)CCC1=C(C2=C(C=C1)S(=O)(=O)CC2S(=O)(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C20H22O7S2/c1-3-27-18(21)12-10-14-9-11-16-19(20(14)26-2)17(13-28(16,22)23)29(24,25)15-7-5-4-6-8-15/h4-9,11,17H,3,10,12-13H2,1-2H3