1-cyclohexyl-2-[4-[(3-phenoxyphenyl)carbamoyl]phenyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclohexyl-2-[4-[(3-phenoxyphenyl)carbamoyl]phenyl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclohexyl-2-[4-[(3-phenoxyphenyl)carbamoyl]phenyl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclohexyl-2-[4-[oxo-(3-phenoxyanilino)methyl]phenyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclohexyl-2-[4-[(3-phenoxyphenyl)carbamoyl]phenyl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclohexyl-2-[4-[(3-phenoxyphenyl)carbamoyl]phenyl]benzimidazole-5-carboxylic acid Formula: C33H29N3O4 MolecularWeight: 531.60106

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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=CC(=CC=C5)OC6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)C(=O)NC5=CC(=CC=C5)OC6=CC=CC=C6

InChI

InChI=1S/C33H29N3O4/c37-32(34-25-8-7-13-28(21-25)40-27-11-5-2-6-12-27)23-16-14-22(15-17-23)31-35-29-20-24(33(38)39)18-19-30(29)36(31)26-9-3-1-4-10-26/h2,5-8,11-21,26H,1,3-4,9-10H2,(H,34,37)(H,38,39)