4-[[2-oxidanylidene-3-[[1-(3-oxidanylpropyl)benzimidazol-2-yl]methyl]benzimidazol-1-yl]methyl]benzoic acid

Systemtic Name: 4-[[2-oxidanylidene-3-[[1-(3-oxidanylpropyl)benzimidazol-2-yl]methyl]benzimidazol-1-yl]methyl]benzoic acid Openeye Name: 4-[[3-[[1-(3-hydroxypropyl)benzimidazol-2-yl]methyl]-2-oxo-benzimidazol-1-yl]methyl]benzoic acid CAS Name: 4-[[3-[[1-(3-hydroxypropyl)-2-benzimidazolyl]methyl]-2-oxo-1-benzimidazolyl]methyl]benzoic acid IUPAC Name: 4-[[3-[[1-(3-hydroxypropyl)benzimidazol-2-yl]methyl]-2-oxobenzimidazol-1-yl]methyl]benzoic acid Traditional Name: 4-[[3-[[1-(3-hydroxypropyl)benzimidazol-2-yl]methyl]-2-keto-benzimidazol-1-yl]methyl]benzoic acid Formula: C26H24N4O4 MolecularWeight: 456.49316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2CCCO)CN3C4=CC=CC=C4N(C3=O)CC5=CC=C(C=C5)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2CCCO)CN3C4=CC=CC=C4N(C3=O)CC5=CC=C(C=C5)C(=O)O

InChI

InChI=1S/C26H24N4O4/c31-15-5-14-28-21-7-2-1-6-20(21)27-24(28)17-30-23-9-4-3-8-22(23)29(26(30)34)16-18-10-12-19(13-11-18)25(32)33/h1-4,6-13,31H,5,14-17H2,(H,32,33)