1-[6-(2-chloranyl-4-methoxy-phenoxy)hexyl]imidazole-4,5-dicarboxylic acid

Systemtic Name: 1-[6-(2-chloranyl-4-methoxy-phenoxy)hexyl]imidazole-4,5-dicarboxylic acid Openeye Name: 1-[6-(2-chloro-4-methoxy-phenoxy)hexyl]imidazole-4,5-dicarboxylic acid CAS Name: 1-[6-(2-chloro-4-methoxyphenoxy)hexyl]imidazole-4,5-dicarboxylic acid IUPAC Name: 1-[6-(2-chloro-4-methoxyphenoxy)hexyl]imidazole-4,5-dicarboxylic acid Traditional Name: 1-[6-(2-chloro-4-methoxy-phenoxy)hexyl]imidazole-4,5-dicarboxylic acid Formula: C18H21ClN2O6 MolecularWeight: 396.82214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OCCCCCCN2C=NC(=C2C(=O)O)C(=O)O)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OCCCCCCN2C=NC(=C2C(=O)O)C(=O)O)Cl

InChI

InChI=1S/C18H21ClN2O6/c1-26-12-6-7-14(13(19)10-12)27-9-5-3-2-4-8-21-11-20-15(17(22)23)16(21)18(24)25/h6-7,10-11H,2-5,8-9H2,1H3,(H,22,23)(H,24,25)