3-[[2-azanylidene-3-[3-(4-fluoranylphenoxy)propyl]benzimidazol-1-yl]methyl]benzoic acid

Systemtic Name: 3-[[2-azanylidene-3-[3-(4-fluoranylphenoxy)propyl]benzimidazol-1-yl]methyl]benzoic acid Openeye Name: 3-[[3-[3-(4-fluorophenoxy)propyl]-2-imino-benzimidazol-1-yl]methyl]benzoic acid CAS Name: 3-[[3-[3-(4-fluorophenoxy)propyl]-2-imino-1-benzimidazolyl]methyl]benzoic acid IUPAC Name: 3-[[3-[3-(4-fluorophenoxy)propyl]-2-iminobenzimidazol-1-yl]methyl]benzoic acid Traditional Name: 3-[[3-[3-(4-fluorophenoxy)propyl]-2-imino-benzimidazol-1-yl]methyl]benzoic acid Formula: C24H22FN3O3 MolecularWeight: 419.448183

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=N)N2CC3=CC=CC(=C3)C(=O)O)CCCOC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=N)N2CC3=CC=CC(=C3)C(=O)O)CCCOC4=CC=C(C=C4)F

InChI

InChI=1S/C24H22FN3O3/c25-19-9-11-20(12-10-19)31-14-4-13-27-21-7-1-2-8-22(21)28(24(27)26)16-17-5-3-6-18(15-17)23(29)30/h1-3,5-12,15,26H,4,13-14,16H2,(H,29,30)