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

Systemtic Name: 4-butyl-1-[[4-[2-[2-(triphenylmethyl)-1,2,3,4-tetrazol-5-yl]phenyl]phenyl]methyl]imidazole-2-carbaldehyde Openeye Name: 4-butyl-1-[[4-[2-(2-trityltetrazol-5-yl)phenyl]phenyl]methyl]imidazole-2-carbaldehyde CAS Name: 4-butyl-1-[[4-[2-[2-(triphenylmethyl)-5-tetrazolyl]phenyl]phenyl]methyl]-2-imidazolecarboxaldehyde IUPAC Name: 4-butyl-1-[[4-[2-(2-trityltetrazol-5-yl)phenyl]phenyl]methyl]imidazole-2-carbaldehyde Traditional Name: 4-butyl-1-[4-[2-(2-trityltetrazol-5-yl)phenyl]benzyl]imidazole-2-carbaldehyde Formula: C41H36N6O MolecularWeight: 628.76414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN(C(=N1)C=O)CC2=CC=C(C=C2)C3=CC=CC=C3C4=NN(N=N4)C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

CCCCC1=CN(C(=N1)C=O)CC2=CC=C(C=C2)C3=CC=CC=C3C4=NN(N=N4)C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C41H36N6O/c1-2-3-21-36-29-46(39(30-48)42-36)28-31-24-26-32(27-25-31)37-22-13-14-23-38(37)40-43-45-47(44-40)41(33-15-7-4-8-16-33,34-17-9-5-10-18-34)35-19-11-6-12-20-35/h4-20,22-27,29-30H,2-3,21,28H2,1H3