2-[4-[[4-methyl-6-(5-methyl-1,3-benzoxazol-2-yl)-2-propyl-benzimidazol-1-yl]methyl]phenyl]benzoic acid

Systemtic Name: 2-[4-[[4-methyl-6-(5-methyl-1,3-benzoxazol-2-yl)-2-propyl-benzimidazol-1-yl]methyl]phenyl]benzoic acid Openeye Name: 2-[4-[[4-methyl-6-(5-methyl-1,3-benzoxazol-2-yl)-2-propyl-benzimidazol-1-yl]methyl]phenyl]benzoic acid CAS Name: 2-[4-[[4-methyl-6-(5-methyl-1,3-benzoxazol-2-yl)-2-propyl-1-benzimidazolyl]methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[[4-methyl-6-(5-methyl-1,3-benzoxazol-2-yl)-2-propylbenzimidazol-1-yl]methyl]phenyl]benzoic acid Traditional Name: 2-[4-[[4-methyl-6-(5-methyl-1,3-benzoxazol-2-yl)-2-propyl-benzimidazol-1-yl]methyl]phenyl]benzoic acid Formula: C33H29N3O3 MolecularWeight: 515.60166

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=C(C=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C5=NC6=C(O5)C=CC(=C6)C)C

Isomeric SMILES

CCCC1=NC2=C(C=C(C=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C5=NC6=C(O5)C=CC(=C6)C)C

InChI

InChI=1S/C33H29N3O3/c1-4-7-30-35-31-21(3)17-24(32-34-27-16-20(2)10-15-29(27)39-32)18-28(31)36(30)19-22-11-13-23(14-12-22)25-8-5-6-9-26(25)33(37)38/h5-6,8-18H,4,7,19H2,1-3H3,(H,37,38)