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

Systemtic Name: (2-oxidanylidene-2-piperidin-1-yl-ethyl) 4,5-dihydrobenzo[g][1]benzothiole-2-carboxylate Openeye Name: [2-oxo-2-(1-piperidyl)ethyl] 4,5-dihydrobenzo[g]benzothiophene-2-carboxylate CAS Name: 4,5-dihydrobenzo[g][1]benzothiole-2-carboxylic acid [2-oxo-2-(1-piperidinyl)ethyl] ester IUPAC Name: (2-oxo-2-piperidin-1-ylethyl) 4,5-dihydrobenzo[g][1]benzothiole-2-carboxylate Traditional Name: 4,5-dihydrobenzo[g]benzothiophene-2-carboxylic acid (2-keto-2-piperidino-ethyl) ester Formula: C20H21NO3S MolecularWeight: 355.45064

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)COC(=O)C2=CC3=C(S2)C4=CC=CC=C4CC3

Isomeric SMILES

C1CCN(CC1)C(=O)COC(=O)C2=CC3=C(S2)C4=CC=CC=C4CC3

InChI

InChI=1S/C20H21NO3S/c22-18(21-10-4-1-5-11-21)13-24-20(23)17-12-15-9-8-14-6-2-3-7-16(14)19(15)25-17/h2-3,6-7,12H,1,4-5,8-11,13H2