2-(1,3-benzodioxol-5-yl)-3-[2-ethyl-1-[(2-methylpropan-2-yl)oxycarbonyl]imidazol-4-yl]propanoic acid

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-3-[2-ethyl-1-[(2-methylpropan-2-yl)oxycarbonyl]imidazol-4-yl]propanoic acid Openeye Name: 2-(1,3-benzodioxol-5-yl)-3-(1-tert-butoxycarbonyl-2-ethyl-imidazol-4-yl)propanoic acid CAS Name: 2-(1,3-benzodioxol-5-yl)-3-[2-ethyl-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-imidazolyl]propanoic acid IUPAC Name: 2-(1,3-benzodioxol-5-yl)-3-[2-ethyl-1-[(2-methylpropan-2-yl)oxycarbonyl]imidazol-4-yl]propanoic acid Traditional Name: 2-(1,3-benzodioxol-5-yl)-3-(1-tert-butoxycarbonyl-2-ethyl-imidazol-4-yl)propionic acid Formula: C20H24N2O6 MolecularWeight: 388.41436

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=CN1C(=O)OC(C)(C)C)CC(C2=CC3=C(C=C2)OCO3)C(=O)O

Isomeric SMILES

CCC1=NC(=CN1C(=O)OC(C)(C)C)CC(C2=CC3=C(C=C2)OCO3)C(=O)O

InChI

InChI=1S/C20H24N2O6/c1-5-17-21-13(10-22(17)19(25)28-20(2,3)4)9-14(18(23)24)12-6-7-15-16(8-12)27-11-26-15/h6-8,10,14H,5,9,11H2,1-4H3,(H,23,24)