ethyl 4-methyl-2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]benzenesulfonate

Systemtic Name: ethyl 4-methyl-2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]benzenesulfonate Openeye Name: ethyl 2-[4-(tert-butoxycarbonylamino)phenyl]-4-methyl-benzenesulfonate CAS Name: 4-methyl-2-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl]benzenesulfonic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]benzenesulfonate Traditional Name: 2-[4-(tert-butoxycarbonylamino)phenyl]-4-methyl-benzenesulfonic acid ethyl ester Formula: C20H25NO5S MolecularWeight: 391.4812

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Descriptors Computed from Structure

Canonical SMILES:

CCOS(=O)(=O)C1=C(C=C(C=C1)C)C2=CC=C(C=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOS(=O)(=O)C1=C(C=C(C=C1)C)C2=CC=C(C=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C20H25NO5S/c1-6-25-27(23,24)18-12-7-14(2)13-17(18)15-8-10-16(11-9-15)21-19(22)26-20(3,4)5/h7-13H,6H2,1-5H3,(H,21,22)