[1-[(2,4-dichlorophenyl)amino]-1-oxidanylidene-propan-2-yl] 3H-benzimidazole-5-carboxylate

Systemtic Name: [1-[(2,4-dichlorophenyl)amino]-1-oxidanylidene-propan-2-yl] 3H-benzimidazole-5-carboxylate Openeye Name: [2-(2,4-dichloroanilino)-1-methyl-2-oxo-ethyl] 3H-benzimidazole-5-carboxylate CAS Name: 3H-benzimidazole-5-carboxylic acid [1-(2,4-dichloroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,4-dichloroanilino)-1-oxopropan-2-yl] 3H-benzimidazole-5-carboxylate Traditional Name: 3H-benzimidazole-5-carboxylic acid [2-(2,4-dichloroanilino)-2-keto-1-methyl-ethyl] ester Formula: C17H13Cl2N3O3 MolecularWeight: 378.20942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)Cl)Cl)OC(=O)C2=CC3=C(C=C2)N=CN3

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)Cl)Cl)OC(=O)C2=CC3=C(C=C2)N=CN3

InChI

InChI=1S/C17H13Cl2N3O3/c1-9(16(23)22-13-5-3-11(18)7-12(13)19)25-17(24)10-2-4-14-15(6-10)21-8-20-14/h2-9H,1H3,(H,20,21)(H,22,23)