tert-butyl 1-thia-7-azacyclododecane-7-carboxylate

Systemtic Name: tert-butyl 1-thia-7-azacyclododecane-7-carboxylate Openeye Name: tert-butyl 1-thia-7-azacyclododecane-7-carboxylate CAS Name: 1-thia-7-azacyclododecane-7-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-thia-7-azacyclododecane-7-carboxylate Traditional Name: 1-thia-7-azacyclododecane-7-carboxylic acid tert-butyl ester Formula: C15H29NO2S MolecularWeight: 287.46126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCCCSCCCCC1

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCCCSCCCCC1

InChI

InChI=1S/C15H29NO2S/c1-15(2,3)18-14(17)16-10-6-4-8-12-19-13-9-5-7-11-16/h4-13H2,1-3H3