2-(hydroxymethyl)-5-(2-oxidanylpropan-2-yl)-3-[[4-[2-[1-(triphenylmethyl)-1,2,3,4-tetrazol-5-yl]phenyl]phenyl]methyl]imidazole-4-carboxylic acid

Systemtic Name: 2-(hydroxymethyl)-5-(2-oxidanylpropan-2-yl)-3-[[4-[2-[1-(triphenylmethyl)-1,2,3,4-tetrazol-5-yl]phenyl]phenyl]methyl]imidazole-4-carboxylic acid Openeye Name: 2-(hydroxymethyl)-5-(1-hydroxy-1-methyl-ethyl)-3-[[4-[2-(1-trityltetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carboxylic acid CAS Name: 2-(hydroxymethyl)-5-(2-hydroxypropan-2-yl)-3-[[4-[2-[1-(triphenylmethyl)-5-tetrazolyl]phenyl]phenyl]methyl]-4-imidazolecarboxylic acid IUPAC Name: 2-(hydroxymethyl)-5-(2-hydroxypropan-2-yl)-3-[[4-[2-(1-trityltetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carboxylic acid Traditional Name: 5-(1-hydroxy-1-methyl-ethyl)-2-methylol-3-[4-[2-(1-trityltetrazol-5-yl)phenyl]benzyl]imidazole-4-carboxylic acid Formula: C41H36N6O4 MolecularWeight: 676.76234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=C(N(C(=N1)CO)CC2=CC=C(C=C2)C3=CC=CC=C3C4=NN=NN4C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)C(=O)O)O

Isomeric SMILES

CC(C)(C1=C(N(C(=N1)CO)CC2=CC=C(C=C2)C3=CC=CC=C3C4=NN=NN4C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)C(=O)O)O

InChI

InChI=1S/C41H36N6O4/c1-40(2,51)37-36(39(49)50)46(35(27-48)42-37)26-28-22-24-29(25-23-28)33-20-12-13-21-34(33)38-43-44-45-47(38)41(30-14-6-3-7-15-30,31-16-8-4-9-17-31)32-18-10-5-11-19-32/h3-25,48,51H,26-27H2,1-2H3,(H,49,50)