methyl 2-aminocarbonyl-4,5-bis[(2-iodanylphenyl)amino]benzoate

Systemtic Name: methyl 2-aminocarbonyl-4,5-bis[(2-iodanylphenyl)amino]benzoate Openeye Name: methyl 2-carbamoyl-4,5-bis(2-iodoanilino)benzoate CAS Name: 2-carbamoyl-4,5-bis(2-iodoanilino)benzoic acid methyl ester IUPAC Name: methyl 2-carbamoyl-4,5-bis(2-iodoanilino)benzoate Traditional Name: 2-carbamoyl-4,5-bis(2-iodoanilino)benzoic acid methyl ester Formula: C21H17I2N3O3 MolecularWeight: 613.18692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1C(=O)N)NC2=CC=CC=C2I)NC3=CC=CC=C3I

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1C(=O)N)NC2=CC=CC=C2I)NC3=CC=CC=C3I

InChI

InChI=1S/C21H17I2N3O3/c1-29-21(28)13-11-19(26-17-9-5-3-7-15(17)23)18(10-12(13)20(24)27)25-16-8-4-2-6-14(16)22/h2-11,25-26H,1H3,(H2,24,27)