2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]thian-4-yl]ethanoate

Systemtic Name: 2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]thian-4-yl]ethanoate Openeye Name: 2-[4-(tert-butoxycarbonylamino)tetrahydrothiopyran-4-yl]acetate CAS Name: 2-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-thianyl]acetate IUPAC Name: 2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]thian-4-yl]acetate Traditional Name: 2-[4-(tert-butoxycarbonylamino)tetrahydrothiopyran-4-yl]acetate Formula: C12H20NO4S- MolecularWeight: 274.3565

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1(CCSCC1)CC(=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NC1(CCSCC1)CC(=O)[O-]

InChI

InChI=1S/C12H21NO4S/c1-11(2,3)17-10(16)13-12(8-9(14)15)4-6-18-7-5-12/h4-8H2,1-3H3,(H,13,16)(H,14,15)/p-1