2-[4-(2H-benzotriazol-5-ylcarbamoyl)phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[4-(2H-benzotriazol-5-ylcarbamoyl)phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Openeye Name: 2-[4-(2H-benzotriazol-5-ylcarbamoyl)phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid CAS Name: 2-[4-[(2H-benzotriazol-5-ylamino)-oxomethyl]phenyl]-1-cyclohexyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-[4-(2H-benzotriazol-5-ylcarbamoyl)phenyl]-1-cyclohexylbenzimidazole-5-carboxylic acid Traditional Name: 2-[4-(2H-benzotriazol-5-ylcarbamoyl)phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Formula: C27H24N6O3 MolecularWeight: 480.51786

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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)C(=O)NC5=CC6=NNN=C6C=C5

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)C(=O)NC5=CC6=NNN=C6C=C5

InChI

InChI=1S/C27H24N6O3/c34-26(28-19-11-12-21-22(15-19)31-32-30-21)17-8-6-16(7-9-17)25-29-23-14-18(27(35)36)10-13-24(23)33(25)20-4-2-1-3-5-20/h6-15,20H,1-5H2,(H,28,34)(H,35,36)(H,30,31,32)