[2-(dimethylamino)-2-oxidanylidene-ethyl] 4,5-dihydrobenzo[g][1]benzothiole-2-carboxylate

Systemtic Name: [2-(dimethylamino)-2-oxidanylidene-ethyl] 4,5-dihydrobenzo[g][1]benzothiole-2-carboxylate Openeye Name: [2-(dimethylamino)-2-oxo-ethyl] 4,5-dihydrobenzo[g]benzothiophene-2-carboxylate CAS Name: 4,5-dihydrobenzo[g][1]benzothiole-2-carboxylic acid [2-(dimethylamino)-2-oxoethyl] ester IUPAC Name: [2-(dimethylamino)-2-oxoethyl] 4,5-dihydrobenzo[g][1]benzothiole-2-carboxylate Traditional Name: 4,5-dihydrobenzo[g]benzothiophene-2-carboxylic acid [2-(dimethylamino)-2-keto-ethyl] ester Formula: C17H17NO3S MolecularWeight: 315.38678

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)COC(=O)C1=CC2=C(S1)C3=CC=CC=C3CC2

Isomeric SMILES

CN(C)C(=O)COC(=O)C1=CC2=C(S1)C3=CC=CC=C3CC2

InChI

InChI=1S/C17H17NO3S/c1-18(2)15(19)10-21-17(20)14-9-12-8-7-11-5-3-4-6-13(11)16(12)22-14/h3-6,9H,7-8,10H2,1-2H3