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

Systemtic Name: ethyl 3-[1,1-bis(oxidanylidene)-2,3-dihydro-1-benzothiophen-3-yl]propanoate Openeye Name: ethyl 3-(1,1-dioxo-2,3-dihydrobenzothiophen-3-yl)propanoate CAS Name: 3-(1,1-dioxo-2,3-dihydro-1-benzothiophen-3-yl)propanoic acid ethyl ester IUPAC Name: ethyl 3-(1,1-dioxo-2,3-dihydro-1-benzothiophen-3-yl)propanoate Traditional Name: 3-(1,1-diketo-2,3-dihydrobenzothiophen-3-yl)propionic acid ethyl ester Formula: C13H16O4S MolecularWeight: 268.32874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1CS(=O)(=O)C2=CC=CC=C12

Isomeric SMILES

CCOC(=O)CCC1CS(=O)(=O)C2=CC=CC=C12

InChI

InChI=1S/C13H16O4S/c1-2-17-13(14)8-7-10-9-18(15,16)12-6-4-3-5-11(10)12/h3-6,10H,2,7-9H2,1H3