1,3-bis[(4-chloranyl-3-propoxy-phenoxy)methyl]-2H-benzimidazol-2-amine

Systemtic Name: 1,3-bis[(4-chloranyl-3-propoxy-phenoxy)methyl]-2H-benzimidazol-2-amine Openeye Name: 1,3-bis[(4-chloro-3-propoxy-phenoxy)methyl]-2H-benzimidazol-2-amine CAS Name: 1,3-bis[(4-chloro-3-propoxyphenoxy)methyl]-2H-benzimidazol-2-amine IUPAC Name: 1,3-bis[(4-chloro-3-propoxyphenoxy)methyl]-2H-benzimidazol-2-amine Traditional Name: [1,3-bis[(4-chloro-3-propoxy-phenoxy)methyl]-2H-benzimidazol-2-yl]amine Formula: C27H31Cl2N3O4 MolecularWeight: 532.45874

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1)OCN2C(N(C3=CC=CC=C32)COC4=CC(=C(C=C4)Cl)OCCC)N)Cl

Isomeric SMILES

CCCOC1=C(C=CC(=C1)OCN2C(N(C3=CC=CC=C32)COC4=CC(=C(C=C4)Cl)OCCC)N)Cl

InChI

InChI=1S/C27H31Cl2N3O4/c1-3-13-33-25-15-19(9-11-21(25)28)35-17-31-23-7-5-6-8-24(23)32(27(31)30)18-36-20-10-12-22(29)26(16-20)34-14-4-2/h5-12,15-16,27H,3-4,13-14,17-18,30H2,1-2H3