methyl 3-[3-(1,3-benzodioxol-5-yl)-5-tert-butyl-4-oxidanyl-phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: methyl 3-[3-(1,3-benzodioxol-5-yl)-5-tert-butyl-4-oxidanyl-phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: methyl 3-[3-(1,3-benzodioxol-5-yl)-5-tert-butyl-4-hydroxy-phenyl]-2-(tert-butoxycarbonylamino)propanoate CAS Name: 3-[3-(1,3-benzodioxol-5-yl)-5-tert-butyl-4-hydroxyphenyl]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[3-(1,3-benzodioxol-5-yl)-5-tert-butyl-4-hydroxyphenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 3-[3-(1,3-benzodioxol-5-yl)-5-tert-butyl-4-hydroxy-phenyl]-2-(tert-butoxycarbonylamino)propionic acid methyl ester Formula: C26H33NO7 MolecularWeight: 471.54272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=CC(=C1)CC(C(=O)OC)NC(=O)OC(C)(C)C)C2=CC3=C(C=C2)OCO3)O

Isomeric SMILES

CC(C)(C)C1=C(C(=CC(=C1)CC(C(=O)OC)NC(=O)OC(C)(C)C)C2=CC3=C(C=C2)OCO3)O

InChI

InChI=1S/C26H33NO7/c1-25(2,3)18-11-15(12-19(23(29)31-7)27-24(30)34-26(4,5)6)10-17(22(18)28)16-8-9-20-21(13-16)33-14-32-20/h8-11,13,19,28H,12,14H2,1-7H3,(H,27,30)