1-piperidin-4-ylpentyl 2H-thiochromene-8-carboxylate

Systemtic Name: 1-piperidin-4-ylpentyl 2H-thiochromene-8-carboxylate Openeye Name: 1-(4-piperidyl)pentyl 2H-thiochromene-8-carboxylate CAS Name: 2H-1-benzothiopyran-8-carboxylic acid 1-(4-piperidinyl)pentyl ester IUPAC Name: 1-piperidin-4-ylpentyl 2H-thiochromene-8-carboxylate Traditional Name: 2H-thiochromene-8-carboxylic acid 1-(4-piperidyl)pentyl ester Formula: C20H27NO2S MolecularWeight: 345.49888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1CCNCC1)OC(=O)C2=CC=CC3=C2SCC=C3

Isomeric SMILES

CCCCC(C1CCNCC1)OC(=O)C2=CC=CC3=C2SCC=C3

InChI

InChI=1S/C20H27NO2S/c1-2-3-9-18(15-10-12-21-13-11-15)23-20(22)17-8-4-6-16-7-5-14-24-19(16)17/h4-8,15,18,21H,2-3,9-14H2,1H3