ethyl 4-[2-(4,5-dihydrobenzo[g][1]benzothiol-2-ylcarbonyloxy)ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(4,5-dihydrobenzo[g][1]benzothiol-2-ylcarbonyloxy)ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(4,5-dihydrobenzo[g]benzothiophene-2-carbonyloxy)acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[4,5-dihydrobenzo[g][1]benzothiol-2-yl(oxo)methoxy]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(4,5-dihydrobenzo[g][1]benzothiole-2-carbonyloxy)acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-(4,5-dihydrobenzo[g]benzothiophene-2-carbonyloxy)acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H24N2O5S MolecularWeight: 428.50136

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)COC(=O)C2=CC3=C(S2)C4=CC=CC=C4CC3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)COC(=O)C2=CC3=C(S2)C4=CC=CC=C4CC3

InChI

InChI=1S/C22H24N2O5S/c1-2-28-22(27)24-11-9-23(10-12-24)19(25)14-29-21(26)18-13-16-8-7-15-5-3-4-6-17(15)20(16)30-18/h3-6,13H,2,7-12,14H2,1H3