2-methyl-2-[3-[3-[2-(4-methylphenyl)carbonylbenzimidazol-1-yl]propyl]phenoxy]propanoic acid

Systemtic Name: 2-methyl-2-[3-[3-[2-(4-methylphenyl)carbonylbenzimidazol-1-yl]propyl]phenoxy]propanoic acid Openeye Name: 2-methyl-2-[3-[3-[2-(4-methylbenzoyl)benzimidazol-1-yl]propyl]phenoxy]propanoic acid CAS Name: 2-methyl-2-[3-[3-[2-[(4-methylphenyl)-oxomethyl]-1-benzimidazolyl]propyl]phenoxy]propanoic acid IUPAC Name: 2-methyl-2-[3-[3-[2-(4-methylbenzoyl)benzimidazol-1-yl]propyl]phenoxy]propanoic acid Traditional Name: 2-methyl-2-[3-[3-(2-p-toluoylbenzimidazol-1-yl)propyl]phenoxy]propionic acid Formula: C28H28N2O4 MolecularWeight: 456.53292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=NC3=CC=CC=C3N2CCCC4=CC(=CC=C4)OC(C)(C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=NC3=CC=CC=C3N2CCCC4=CC(=CC=C4)OC(C)(C)C(=O)O

InChI

InChI=1S/C28H28N2O4/c1-19-13-15-21(16-14-19)25(31)26-29-23-11-4-5-12-24(23)30(26)17-7-9-20-8-6-10-22(18-20)34-28(2,3)27(32)33/h4-6,8,10-16,18H,7,9,17H2,1-3H3,(H,32,33)