2-[4-[bis(4-carboxyphenyl)methoxy]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[4-[bis(4-carboxyphenyl)methoxy]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Openeye Name: 2-[4-[bis(4-carboxyphenyl)methoxy]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid CAS Name: 2-[4-[bis(4-carboxyphenyl)methoxy]phenyl]-1-cyclohexyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-[4-[bis(4-carboxyphenyl)methoxy]phenyl]-1-cyclohexylbenzimidazole-5-carboxylic acid Traditional Name: 2-[4-[bis(4-carboxyphenyl)methoxy]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Formula: C35H30N2O7 MolecularWeight: 590.6219

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)OC(C5=CC=C(C=C5)C(=O)O)C6=CC=C(C=C6)C(=O)O

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)OC(C5=CC=C(C=C5)C(=O)O)C6=CC=C(C=C6)C(=O)O

InChI

InChI=1S/C35H30N2O7/c38-33(39)24-10-6-21(7-11-24)31(22-8-12-25(13-9-22)34(40)41)44-28-17-14-23(15-18-28)32-36-29-20-26(35(42)43)16-19-30(29)37(32)27-4-2-1-3-5-27/h6-20,27,31H,1-5H2,(H,38,39)(H,40,41)(H,42,43)