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

Systemtic Name: butyl 3-[3,4-bis(oxidanyl)phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: butyl 2-(tert-butoxycarbonylamino)-3-(3,4-dihydroxyphenyl)propanoate CAS Name: 3-(3,4-dihydroxyphenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid butyl ester IUPAC Name: butyl 3-(3,4-dihydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 2-(tert-butoxycarbonylamino)-3-(3,4-dihydroxyphenyl)propionic acid butyl ester Formula: C18H27NO6 MolecularWeight: 353.41008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(CC1=CC(=C(C=C1)O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCOC(=O)C(CC1=CC(=C(C=C1)O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C18H27NO6/c1-5-6-9-24-16(22)13(19-17(23)25-18(2,3)4)10-12-7-8-14(20)15(21)11-12/h7-8,11,13,20-21H,5-6,9-10H2,1-4H3,(H,19,23)