methyl 1-(4,5-dihydrobenzo[g][1]benzothiol-2-ylcarbonyl)piperidine-4-carboxylate

Systemtic Name: methyl 1-(4,5-dihydrobenzo[g][1]benzothiol-2-ylcarbonyl)piperidine-4-carboxylate Openeye Name: methyl 1-(4,5-dihydrobenzo[g]benzothiophene-2-carbonyl)piperidine-4-carboxylate CAS Name: 1-[4,5-dihydrobenzo[g][1]benzothiol-2-yl(oxo)methyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4,5-dihydrobenzo[g][1]benzothiole-2-carbonyl)piperidine-4-carboxylate Traditional Name: 1-(4,5-dihydrobenzo[g]benzothiophene-2-carbonyl)isonipecotic acid methyl ester Formula: C20H21NO3S MolecularWeight: 355.45064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21NO3S/c1-24-20(23)14-8-10-21(11-9-14)19(22)17-12-15-7-6-13-4-2-3-5-16(13)18(15)25-17/h2-5,12,14H,6-11H2,1H3