3-[3,4-bis(oxidanyl)phenyl]-2-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: 3-[3,4-bis(oxidanyl)phenyl]-2-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: 2-(tert-butoxycarbonylamino)-3-(3,4-dihydroxyphenyl)-2-methyl-propanoate CAS Name: 3-(3,4-dihydroxyphenyl)-2-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoate IUPAC Name: 3-(3,4-dihydroxyphenyl)-2-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 2-(tert-butoxycarbonylamino)-3-(3,4-dihydroxyphenyl)-2-methyl-propionate Formula: C15H20NO6- MolecularWeight: 310.3224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C)(CC1=CC(=C(C=C1)O)O)C(=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NC(C)(CC1=CC(=C(C=C1)O)O)C(=O)[O-]

InChI

InChI=1S/C15H21NO6/c1-14(2,3)22-13(21)16-15(4,12(19)20)8-9-5-6-10(17)11(18)7-9/h5-7,17-18H,8H2,1-4H3,(H,16,21)(H,19,20)/p-1