1,3-bis[(2-ethyl-5-methoxy-phenoxy)methyl]-2H-benzimidazol-2-amine bromide

Systemtic Name: 1,3-bis[(2-ethyl-5-methoxy-phenoxy)methyl]-2H-benzimidazol-2-amine bromide Openeye Name: 1,3-bis[(2-ethyl-5-methoxy-phenoxy)methyl]-2H-benzimidazol-2-amine bromide CAS Name: 1,3-bis[(2-ethyl-5-methoxyphenoxy)methyl]-2H-benzimidazol-2-amine bromide IUPAC Name: 1,3-bis[(2-ethyl-5-methoxyphenoxy)methyl]-2H-benzimidazol-2-amine bromide Traditional Name: [1,3-bis[(2-ethyl-5-methoxy-phenoxy)methyl]-2H-benzimidazol-2-yl]amine bromide Formula: C27H33BrN3O4- MolecularWeight: 543.47262

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)OC)OCN2C(N(C3=CC=CC=C32)COC4=C(C=CC(=C4)OC)CC)N.[Br-]

Isomeric SMILES

CCC1=C(C=C(C=C1)OC)OCN2C(N(C3=CC=CC=C32)COC4=C(C=CC(=C4)OC)CC)N.[Br-]

InChI

InChI=1S/C27H33N3O4.BrH/c1-5-19-11-13-21(31-3)15-25(19)33-17-29-23-9-7-8-10-24(23)30(27(29)28)18-34-26-16-22(32-4)14-12-20(26)6-2;/h7-16,27H,5-6,17-18,28H2,1-4H3;1H/p-1