8-[4,5-bis(4-methoxyphenyl)-1-phenyl-imidazol-2-yl]sulfanyloctanoic acid

Systemtic Name: 8-[4,5-bis(4-methoxyphenyl)-1-phenyl-imidazol-2-yl]sulfanyloctanoic acid Openeye Name: 8-[4,5-bis(4-methoxyphenyl)-1-phenyl-imidazol-2-yl]sulfanyloctanoic acid CAS Name: 8-[[4,5-bis(4-methoxyphenyl)-1-phenyl-2-imidazolyl]thio]octanoic acid IUPAC Name: 8-[4,5-bis(4-methoxyphenyl)-1-phenylimidazol-2-yl]sulfanyloctanoic acid Traditional Name: 8-[[4,5-bis(4-methoxyphenyl)-1-phenyl-imidazol-2-yl]thio]caprylic acid Formula: C31H34N2O4S MolecularWeight: 530.67766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(N(C(=N2)SCCCCCCCC(=O)O)C3=CC=CC=C3)C4=CC=C(C=C4)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(N(C(=N2)SCCCCCCCC(=O)O)C3=CC=CC=C3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C31H34N2O4S/c1-36-26-18-14-23(15-19-26)29-30(24-16-20-27(37-2)21-17-24)33(25-11-7-6-8-12-25)31(32-29)38-22-10-5-3-4-9-13-28(34)35/h6-8,11-12,14-21H,3-5,9-10,13,22H2,1-2H3,(H,34,35)