8-[2-(6-oxidanylidenehexyl)-4,5-diphenyl-imidazol-1-yl]octanoic acid

Systemtic Name: 8-[2-(6-oxidanylidenehexyl)-4,5-diphenyl-imidazol-1-yl]octanoic acid Openeye Name: 8-[2-(6-oxohexyl)-4,5-diphenyl-imidazol-1-yl]octanoic acid CAS Name: 8-[2-(6-oxohexyl)-4,5-diphenyl-1-imidazolyl]octanoic acid IUPAC Name: 8-[2-(6-oxohexyl)-4,5-diphenylimidazol-1-yl]octanoic acid Traditional Name: 8-[2-(6-ketohexyl)-4,5-diphenyl-imidazol-1-yl]caprylic acid Formula: C29H36N2O3 MolecularWeight: 460.60774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N(C(=N2)CCCCCC=O)CCCCCCCC(=O)O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N(C(=N2)CCCCCC=O)CCCCCCCC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C29H36N2O3/c32-23-15-5-3-12-20-26-30-28(24-16-8-6-9-17-24)29(25-18-10-7-11-19-25)31(26)22-14-4-1-2-13-21-27(33)34/h6-11,16-19,23H,1-5,12-15,20-22H2,(H,33,34)