[(2-methylpropan-2-yl)oxycarbonylamino] 4-methylbenzenesulfonate

Systemtic Name: [(2-methylpropan-2-yl)oxycarbonylamino] 4-methylbenzenesulfonate Openeye Name: (tert-butoxycarbonylamino) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [[(2-methylpropan-2-yl)oxy-oxomethyl]amino] ester IUPAC Name: [(2-methylpropan-2-yl)oxycarbonylamino] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (tert-butoxycarbonylamino) ester Formula: C12H17NO5S MolecularWeight: 287.33208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)ONC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)ONC(=O)OC(C)(C)C

InChI

InChI=1S/C12H17NO5S/c1-9-5-7-10(8-6-9)19(15,16)18-13-11(14)17-12(2,3)4/h5-8H,1-4H3,(H,13,14)