[1-[(4-iodophenyl)amino]-1-oxidanylidene-butan-2-yl] 2-(1H-benzimidazol-2-yl)benzoate

Systemtic Name: [1-[(4-iodophenyl)amino]-1-oxidanylidene-butan-2-yl] 2-(1H-benzimidazol-2-yl)benzoate Openeye Name: 1-[(4-iodophenyl)carbamoyl]propyl 2-(1H-benzimidazol-2-yl)benzoate CAS Name: 2-(1H-benzimidazol-2-yl)benzoic acid [1-(4-iodoanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(4-iodoanilino)-1-oxobutan-2-yl] 2-(1H-benzimidazol-2-yl)benzoate Traditional Name: 2-(1H-benzimidazol-2-yl)benzoic acid 1-[(4-iodophenyl)carbamoyl]propyl ester Formula: C24H20IN3O3 MolecularWeight: 525.33837

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)I)OC(=O)C2=CC=CC=C2C3=NC4=CC=CC=C4N3

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)I)OC(=O)C2=CC=CC=C2C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C24H20IN3O3/c1-2-21(23(29)26-16-13-11-15(25)12-14-16)31-24(30)18-8-4-3-7-17(18)22-27-19-9-5-6-10-20(19)28-22/h3-14,21H,2H2,1H3,(H,26,29)(H,27,28)