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

Systemtic Name: [2-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] 4-methylbenzenesulfonate Openeye Name: [2-(tert-butoxycarbonylamino)phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl] ester IUPAC Name: [2-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-(tert-butoxycarbonylamino)phenyl] ester Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2NC(=O)OC(C)(C)C

InChI

InChI=1S/C18H21NO5S/c1-13-9-11-14(12-10-13)25(21,22)24-16-8-6-5-7-15(16)19-17(20)23-18(2,3)4/h5-12H,1-4H3,(H,19,20)