3-[2-ethoxy-6-(1-propan-2-ylimidazol-4-yl)benzimidazol-1-yl]-2-methyl-6-phenyl-benzoic acid

Systemtic Name: 3-[2-ethoxy-6-(1-propan-2-ylimidazol-4-yl)benzimidazol-1-yl]-2-methyl-6-phenyl-benzoic acid Openeye Name: 3-[2-ethoxy-6-(1-isopropylimidazol-4-yl)benzimidazol-1-yl]-2-methyl-6-phenyl-benzoic acid CAS Name: 3-[2-ethoxy-6-(1-propan-2-yl-4-imidazolyl)-1-benzimidazolyl]-2-methyl-6-phenylbenzoic acid IUPAC Name: 3-[2-ethoxy-6-(1-propan-2-ylimidazol-4-yl)benzimidazol-1-yl]-2-methyl-6-phenylbenzoic acid Traditional Name: 3-[2-ethoxy-6-(1-isopropylimidazol-4-yl)benzimidazol-1-yl]-2-methyl-6-phenyl-benzoic acid Formula: C29H28N4O3 MolecularWeight: 480.55762

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC2=C(N1C3=C(C(=C(C=C3)C4=CC=CC=C4)C(=O)O)C)C=C(C=C2)C5=CN(C=N5)C(C)C

Isomeric SMILES

CCOC1=NC2=C(N1C3=C(C(=C(C=C3)C4=CC=CC=C4)C(=O)O)C)C=C(C=C2)C5=CN(C=N5)C(C)C

InChI

InChI=1S/C29H28N4O3/c1-5-36-29-31-23-13-11-21(24-16-32(17-30-24)18(2)3)15-26(23)33(29)25-14-12-22(20-9-7-6-8-10-20)27(19(25)4)28(34)35/h6-18H,5H2,1-4H3,(H,34,35)