(3-tert-butyl-1,2,4-oxadiazol-5-yl)methyl 6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)hexanoate

Systemtic Name: (3-tert-butyl-1,2,4-oxadiazol-5-yl)methyl 6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)hexanoate Openeye Name: (3-tert-butyl-1,2,4-oxadiazol-5-yl)methyl 6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)hexanoate CAS Name: 6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)hexanoic acid (3-tert-butyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-tert-butyl-1,2,4-oxadiazol-5-yl)methyl 6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)hexanoate Traditional Name: 6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)hexanoic acid (3-tert-butyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C21H29N3O7S MolecularWeight: 467.53586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NOC(=N1)COC(=O)CCCCCNS(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC(C)(C)C1=NOC(=N1)COC(=O)CCCCCNS(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C21H29N3O7S/c1-21(2,3)20-23-18(31-24-20)14-30-19(25)7-5-4-6-10-22-32(26,27)15-8-9-16-17(13-15)29-12-11-28-16/h8-9,13,22H,4-7,10-12,14H2,1-3H3