tert-butyl 5-chloranyl-2-(2-oxa-6-azaspiro[2.5]octan-6-ylsulfonyl)benzoate

Systemtic Name: tert-butyl 5-chloranyl-2-(2-oxa-6-azaspiro[2.5]octan-6-ylsulfonyl)benzoate Openeye Name: tert-butyl 5-chloro-2-(2-oxa-6-azaspiro[2.5]octan-6-ylsulfonyl)benzoate CAS Name: 5-chloro-2-(2-oxa-6-azaspiro[2.5]octan-6-ylsulfonyl)benzoic acid tert-butyl ester IUPAC Name: tert-butyl 5-chloro-2-(2-oxa-6-azaspiro[2.5]octan-6-ylsulfonyl)benzoate Traditional Name: 5-chloro-2-(2-oxa-6-azaspiro[2.5]octan-6-ylsulfonyl)benzoic acid tert-butyl ester Formula: C17H22ClNO5S MolecularWeight: 387.87828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(C=CC(=C1)Cl)S(=O)(=O)N2CCC3(CC2)CO3

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(C=CC(=C1)Cl)S(=O)(=O)N2CCC3(CC2)CO3

InChI

InChI=1S/C17H22ClNO5S/c1-16(2,3)24-15(20)13-10-12(18)4-5-14(13)25(21,22)19-8-6-17(7-9-19)11-23-17/h4-5,10H,6-9,11H2,1-3H3