6-(2-imidazol-1-yl-3-methyl-5-phenylmethoxy-indol-1-yl)hexanoic acid

Systemtic Name: 6-(2-imidazol-1-yl-3-methyl-5-phenylmethoxy-indol-1-yl)hexanoic acid Openeye Name: 6-(5-benzyloxy-2-imidazol-1-yl-3-methyl-indol-1-yl)hexanoic acid CAS Name: 6-[2-(1-imidazolyl)-3-methyl-5-phenylmethoxy-1-indolyl]hexanoic acid IUPAC Name: 6-(2-imidazol-1-yl-3-methyl-5-phenylmethoxyindol-1-yl)hexanoic acid Traditional Name: 6-(5-benzoxy-2-imidazol-1-yl-3-methyl-indol-1-yl)hexanoic acid Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=C(C=C2)OCC3=CC=CC=C3)CCCCCC(=O)O)N4C=CN=C4

Isomeric SMILES

CC1=C(N(C2=C1C=C(C=C2)OCC3=CC=CC=C3)CCCCCC(=O)O)N4C=CN=C4

InChI

InChI=1S/C25H27N3O3/c1-19-22-16-21(31-17-20-8-4-2-5-9-20)11-12-23(22)28(14-7-3-6-10-24(29)30)25(19)27-15-13-26-18-27/h2,4-5,8-9,11-13,15-16,18H,3,6-7,10,14,17H2,1H3,(H,29,30)