(2-morpholin-4-yl-2-oxidanylidene-ethyl) 7-methoxy-4,5-dihydrobenzo[g][1]benzothiole-2-carboxylate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-ethyl) 7-methoxy-4,5-dihydrobenzo[g][1]benzothiole-2-carboxylate Openeye Name: (2-morpholino-2-oxo-ethyl) 7-methoxy-4,5-dihydrobenzo[g]benzothiophene-2-carboxylate CAS Name: 7-methoxy-4,5-dihydrobenzo[g][1]benzothiole-2-carboxylic acid [2-(4-morpholinyl)-2-oxoethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxoethyl) 7-methoxy-4,5-dihydrobenzo[g][1]benzothiole-2-carboxylate Traditional Name: 7-methoxy-4,5-dihydrobenzo[g]benzothiophene-2-carboxylic acid (2-keto-2-morpholino-ethyl) ester Formula: C20H21NO5S MolecularWeight: 387.44944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=C(CC2)C=C(S3)C(=O)OCC(=O)N4CCOCC4

Isomeric SMILES

COC1=CC2=C(C=C1)C3=C(CC2)C=C(S3)C(=O)OCC(=O)N4CCOCC4

InChI

InChI=1S/C20H21NO5S/c1-24-15-4-5-16-13(10-15)2-3-14-11-17(27-19(14)16)20(23)26-12-18(22)21-6-8-25-9-7-21/h4-5,10-11H,2-3,6-9,12H2,1H3