ethyl 2-butyl-5-(3-oxidanylpentan-3-yl)-3-[[4-[2-[1-(triphenylmethyl)-1,2,3,4-tetrazol-5-yl]phenyl]phenyl]methyl]imidazole-4-carboxylate

Systemtic Name: ethyl 2-butyl-5-(3-oxidanylpentan-3-yl)-3-[[4-[2-[1-(triphenylmethyl)-1,2,3,4-tetrazol-5-yl]phenyl]phenyl]methyl]imidazole-4-carboxylate Openeye Name: ethyl 2-butyl-5-(1-ethyl-1-hydroxy-propyl)-3-[[4-[2-(1-trityltetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carboxylate CAS Name: 2-butyl-5-(3-hydroxypentan-3-yl)-3-[[4-[2-[1-(triphenylmethyl)-5-tetrazolyl]phenyl]phenyl]methyl]-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-butyl-5-(3-hydroxypentan-3-yl)-3-[[4-[2-(1-trityltetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carboxylate Traditional Name: 2-butyl-5-(1-ethyl-1-hydroxy-propyl)-3-[4-[2-(1-trityltetrazol-5-yl)phenyl]benzyl]imidazole-4-carboxylic acid ethyl ester Formula: C48H50N6O3 MolecularWeight: 758.949

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C4=NN=NN4C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)C(=O)OCC)C(CC)(CC)O

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C4=NN=NN4C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)C(=O)OCC)C(CC)(CC)O

InChI

InChI=1S/C48H50N6O3/c1-5-9-29-42-49-44(47(56,6-2)7-3)43(46(55)57-8-4)53(42)34-35-30-32-36(33-31-35)40-27-19-20-28-41(40)45-50-51-52-54(45)48(37-21-13-10-14-22-37,38-23-15-11-16-24-38)39-25-17-12-18-26-39/h10-28,30-33,56H,5-9,29,34H2,1-4H3