1-[(4-tert-butylphenyl)methyl]-2-[1-[(4-tert-butylphenyl)methyl]-4-carboxy-benzimidazol-2-yl]benzimidazole-4-carboxylic acid

Systemtic Name: 1-[(4-tert-butylphenyl)methyl]-2-[1-[(4-tert-butylphenyl)methyl]-4-carboxy-benzimidazol-2-yl]benzimidazole-4-carboxylic acid Openeye Name: 1-[(4-tert-butylphenyl)methyl]-2-[1-[(4-tert-butylphenyl)methyl]-4-carboxy-benzimidazol-2-yl]benzimidazole-4-carboxylic acid CAS Name: 1-[(4-tert-butylphenyl)methyl]-2-[1-[(4-tert-butylphenyl)methyl]-4-carboxy-2-benzimidazolyl]-4-benzimidazolecarboxylic acid IUPAC Name: 1-[(4-tert-butylphenyl)methyl]-2-[1-[(4-tert-butylphenyl)methyl]-4-carboxybenzimidazol-2-yl]benzimidazole-4-carboxylic acid Traditional Name: 1-(4-tert-butylbenzyl)-2-[1-(4-tert-butylbenzyl)-4-carboxy-benzimidazol-2-yl]benzimidazole-4-carboxylic acid Formula: C38H38N4O4 MolecularWeight: 614.73272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2C3=CC=CC(=C3N=C2C4=NC5=C(C=CC=C5N4CC6=CC=C(C=C6)C(C)(C)C)C(=O)O)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2C3=CC=CC(=C3N=C2C4=NC5=C(C=CC=C5N4CC6=CC=C(C=C6)C(C)(C)C)C(=O)O)C(=O)O

InChI

InChI=1S/C38H38N4O4/c1-37(2,3)25-17-13-23(14-18-25)21-41-29-11-7-9-27(35(43)44)31(29)39-33(41)34-40-32-28(36(45)46)10-8-12-30(32)42(34)22-24-15-19-26(20-16-24)38(4,5)6/h7-20H,21-22H2,1-6H3,(H,43,44)(H,45,46)