1,3-bis[3-(4-chloranyl-3-propoxy-phenyl)propyl]benzimidazol-2-imine hydrobromide

Systemtic Name: 1,3-bis[3-(4-chloranyl-3-propoxy-phenyl)propyl]benzimidazol-2-imine hydrobromide Openeye Name: 1,3-bis[3-(4-chloro-3-propoxy-phenyl)propyl]benzimidazol-2-imine hydrobromide CAS Name: 1,3-bis[3-(4-chloro-3-propoxyphenyl)propyl]-2-benzimidazolimine hydrobromide IUPAC Name: 1,3-bis[3-(4-chloro-3-propoxyphenyl)propyl]benzimidazol-2-imine hydrobromide Traditional Name: [1,3-bis[3-(4-chloro-3-propoxy-phenyl)propyl]benzimidazol-2-ylidene]amine hydrobromide Formula: C31H38BrCl2N3O2 MolecularWeight: 635.46232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1)CCCN2C3=CC=CC=C3N(C2=N)CCCC4=CC(=C(C=C4)Cl)OCCC)Cl.Br

Isomeric SMILES

CCCOC1=C(C=CC(=C1)CCCN2C3=CC=CC=C3N(C2=N)CCCC4=CC(=C(C=C4)Cl)OCCC)Cl.Br

InChI

InChI=1S/C31H37Cl2N3O2.BrH/c1-3-19-37-29-21-23(13-15-25(29)32)9-7-17-35-27-11-5-6-12-28(27)36(31(35)34)18-8-10-24-14-16-26(33)30(22-24)38-20-4-2;/h5-6,11-16,21-22,34H,3-4,7-10,17-20H2,1-2H3;1H