2,4,6-trimethyl-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]benzenesulfonic acid

Systemtic Name: 2,4,6-trimethyl-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]benzenesulfonic acid Openeye Name: 3-[2-(tert-butoxycarbonylamino)ethyl]-2,4,6-trimethyl-benzenesulfonic acid CAS Name: 2,4,6-trimethyl-3-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]ethyl]benzenesulfonic acid IUPAC Name: 2,4,6-trimethyl-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]benzenesulfonic acid Traditional Name: 3-[2-(tert-butoxycarbonylamino)ethyl]-2,4,6-trimethyl-besylic acid Formula: C16H25NO5S MolecularWeight: 343.4384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1CCNC(=O)OC(C)(C)C)C)S(=O)(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1CCNC(=O)OC(C)(C)C)C)S(=O)(=O)O)C

InChI

InChI=1S/C16H25NO5S/c1-10-9-11(2)14(23(19,20)21)12(3)13(10)7-8-17-15(18)22-16(4,5)6/h9H,7-8H2,1-6H3,(H,17,18)(H,19,20,21)