2-[4-[[5-(ethoxycarbonyloxymethoxycarbonyl)-4-(2-oxidanylpropan-2-yl)-2-propyl-imidazol-1-yl]methyl]phenyl]benzoic acid

Systemtic Name: 2-[4-[[5-(ethoxycarbonyloxymethoxycarbonyl)-4-(2-oxidanylpropan-2-yl)-2-propyl-imidazol-1-yl]methyl]phenyl]benzoic acid Openeye Name: 2-[4-[[5-(ethoxycarbonyloxymethoxycarbonyl)-4-(1-hydroxy-1-methyl-ethyl)-2-propyl-imidazol-1-yl]methyl]phenyl]benzoic acid CAS Name: 2-[4-[[5-[ethoxycarbonyloxymethoxy(oxo)methyl]-4-(2-hydroxypropan-2-yl)-2-propyl-1-imidazolyl]methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[[5-(ethoxycarbonyloxymethoxycarbonyl)-4-(2-hydroxypropan-2-yl)-2-propylimidazol-1-yl]methyl]phenyl]benzoic acid Traditional Name: 2-[4-[[5-(carbethoxyoxymethoxycarbonyl)-4-(1-hydroxy-1-methyl-ethyl)-2-propyl-imidazol-1-yl]methyl]phenyl]benzoic acid Formula: C28H32N2O8 MolecularWeight: 524.56228

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)C(=O)OCOC(=O)OCC)C(C)(C)O

Isomeric SMILES

CCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)C(=O)OCOC(=O)OCC)C(C)(C)O

InChI

InChI=1S/C28H32N2O8/c1-5-9-22-29-24(28(3,4)35)23(26(33)37-17-38-27(34)36-6-2)30(22)16-18-12-14-19(15-13-18)20-10-7-8-11-21(20)25(31)32/h7-8,10-15,35H,5-6,9,16-17H2,1-4H3,(H,31,32)