butyl 3-(1,3-benzodioxol-5-ylcarbonyl)-2-cyclohexyl-1,3-thiazolidine-4-carboxylate

Systemtic Name: butyl 3-(1,3-benzodioxol-5-ylcarbonyl)-2-cyclohexyl-1,3-thiazolidine-4-carboxylate Openeye Name: butyl 3-(1,3-benzodioxole-5-carbonyl)-2-cyclohexyl-thiazolidine-4-carboxylate CAS Name: 3-[1,3-benzodioxol-5-yl(oxo)methyl]-2-cyclohexyl-4-thiazolidinecarboxylic acid butyl ester IUPAC Name: butyl 3-(1,3-benzodioxole-5-carbonyl)-2-cyclohexyl-1,3-thiazolidine-4-carboxylate Traditional Name: 2-cyclohexyl-3-piperonyloyl-thiazolidine-4-carboxylic acid butyl ester Formula: C22H29NO5S MolecularWeight: 419.53436

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1CSC(N1C(=O)C2=CC3=C(C=C2)OCO3)C4CCCCC4

Isomeric SMILES

CCCCOC(=O)C1CSC(N1C(=O)C2=CC3=C(C=C2)OCO3)C4CCCCC4

InChI

InChI=1S/C22H29NO5S/c1-2-3-11-26-22(25)17-13-29-21(15-7-5-4-6-8-15)23(17)20(24)16-9-10-18-19(12-16)28-14-27-18/h9-10,12,15,17,21H,2-8,11,13-14H2,1H3