6-isocyano-2-[(4-phenoxyphenyl)methyl]-1H-benzimidazole

Systemtic Name: 6-isocyano-2-[(4-phenoxyphenyl)methyl]-1H-benzimidazole Openeye Name: 6-isocyano-2-[(4-phenoxyphenyl)methyl]-1H-benzimidazole CAS Name: 6-isocyano-2-[(4-phenoxyphenyl)methyl]-1H-benzimidazole IUPAC Name: 6-isocyano-2-[(4-phenoxyphenyl)methyl]-1H-benzimidazole Traditional Name: 6-isocyano-2-(4-phenoxybenzyl)-1H-benzimidazole Formula: C21H15N3O MolecularWeight: 325.3633

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=CC2=C(C=C1)N=C(N2)CC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

[C-]#[N+]C1=CC2=C(C=C1)N=C(N2)CC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C21H15N3O/c1-22-16-9-12-19-20(14-16)24-21(23-19)13-15-7-10-18(11-8-15)25-17-5-3-2-4-6-17/h2-12,14H,13H2,(H,23,24)