[1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-[(2-iodanylphenyl)carbonylamino]ethanoate

Systemtic Name: [1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-[(2-iodanylphenyl)carbonylamino]ethanoate Openeye Name: [2-(2-cyanoanilino)-1-methyl-2-oxo-ethyl] 2-[(2-iodobenzoyl)amino]acetate CAS Name: 2-[[(2-iodophenyl)-oxomethyl]amino]acetic acid [1-(2-cyanoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-cyanoanilino)-1-oxopropan-2-yl] 2-[(2-iodobenzoyl)amino]acetate Traditional Name: 2-[(2-iodobenzoyl)amino]acetic acid [2-(2-cyanoanilino)-2-keto-1-methyl-ethyl] ester Formula: C19H16IN3O4 MolecularWeight: 477.25251

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C#N)OC(=O)CNC(=O)C2=CC=CC=C2I

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1C#N)OC(=O)CNC(=O)C2=CC=CC=C2I

InChI

InChI=1S/C19H16IN3O4/c1-12(18(25)23-16-9-5-2-6-13(16)10-21)27-17(24)11-22-19(26)14-7-3-4-8-15(14)20/h2-9,12H,11H2,1H3,(H,22,26)(H,23,25)