methyl 8-[1,4,5-tris(4-chlorophenyl)imidazol-2-yl]oxyoctanoate

Systemtic Name: methyl 8-[1,4,5-tris(4-chlorophenyl)imidazol-2-yl]oxyoctanoate Openeye Name: methyl 8-[1,4,5-tris(4-chlorophenyl)imidazol-2-yl]oxyoctanoate CAS Name: 8-[[1,4,5-tris(4-chlorophenyl)-2-imidazolyl]oxy]octanoic acid methyl ester IUPAC Name: methyl 8-[1,4,5-tris(4-chlorophenyl)imidazol-2-yl]oxyoctanoate Traditional Name: 8-[1,4,5-tris(4-chlorophenyl)imidazol-2-yl]oxycaprylic acid methyl ester Formula: C30H29Cl3N2O3 MolecularWeight: 571.92186

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCCOC1=NC(=C(N1C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC(=O)CCCCCCCOC1=NC(=C(N1C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C30H29Cl3N2O3/c1-37-27(36)7-5-3-2-4-6-20-38-30-34-28(21-8-12-23(31)13-9-21)29(22-10-14-24(32)15-11-22)35(30)26-18-16-25(33)17-19-26/h8-19H,2-7,20H2,1H3