2-butyl-5-propanoyl-3-(triphenylmethyl)imidazole-4-carbonitrile

Systemtic Name: 2-butyl-5-propanoyl-3-(triphenylmethyl)imidazole-4-carbonitrile Openeye Name: 2-butyl-5-propanoyl-3-trityl-imidazole-4-carbonitrile CAS Name: 2-butyl-5-(1-oxopropyl)-3-(triphenylmethyl)-4-imidazolecarbonitrile IUPAC Name: 2-butyl-5-propanoyl-3-tritylimidazole-4-carbonitrile Traditional Name: 2-butyl-5-propionyl-3-trityl-imidazole-4-carbonitrile Formula: C30H29N3O MolecularWeight: 447.57076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C#N)C(=O)CC

Isomeric SMILES

CCCCC1=NC(=C(N1C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C#N)C(=O)CC

InChI

InChI=1S/C30H29N3O/c1-3-5-21-28-32-29(27(34)4-2)26(22-31)33(28)30(23-15-9-6-10-16-23,24-17-11-7-12-18-24)25-19-13-8-14-20-25/h6-20H,3-5,21H2,1-2H3