6-(2,3-diphenylbenzimidazol-5-yl)oxy-2,2-dimethyl-hexanenitrile

Systemtic Name: 6-(2,3-diphenylbenzimidazol-5-yl)oxy-2,2-dimethyl-hexanenitrile Openeye Name: 6-(2,3-diphenylbenzimidazol-5-yl)oxy-2,2-dimethyl-hexanenitrile CAS Name: 6-[(2,3-diphenyl-5-benzimidazolyl)oxy]-2,2-dimethylhexanenitrile IUPAC Name: 6-(2,3-diphenylbenzimidazol-5-yl)oxy-2,2-dimethylhexanenitrile Traditional Name: 6-(2,3-diphenylbenzimidazol-5-yl)oxy-2,2-dimethyl-hexanenitrile Formula: C27H27N3O MolecularWeight: 409.52278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCOC1=CC2=C(C=C1)N=C(N2C3=CC=CC=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

CC(C)(CCCCOC1=CC2=C(C=C1)N=C(N2C3=CC=CC=C3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C27H27N3O/c1-27(2,20-28)17-9-10-18-31-23-15-16-24-25(19-23)30(22-13-7-4-8-14-22)26(29-24)21-11-5-3-6-12-21/h3-8,11-16,19H,9-10,17-18H2,1-2H3