[1-[(4-acetamidophenyl)amino]-1-oxidanylidene-propan-2-yl] 4-iodanylbenzoate

Systemtic Name: [1-[(4-acetamidophenyl)amino]-1-oxidanylidene-propan-2-yl] 4-iodanylbenzoate Openeye Name: [2-(4-acetamidoanilino)-1-methyl-2-oxo-ethyl] 4-iodobenzoate CAS Name: 4-iodobenzoic acid [1-(4-acetamidoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-acetamidoanilino)-1-oxopropan-2-yl] 4-iodobenzoate Traditional Name: 4-iodobenzoic acid [2-(4-acetamidoanilino)-2-keto-1-methyl-ethyl] ester Formula: C18H17IN2O4 MolecularWeight: 452.24305

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)NC(=O)C)OC(=O)C2=CC=C(C=C2)I

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)NC(=O)C)OC(=O)C2=CC=C(C=C2)I

InChI

InChI=1S/C18H17IN2O4/c1-11(25-18(24)13-3-5-14(19)6-4-13)17(23)21-16-9-7-15(8-10-16)20-12(2)22/h3-11H,1-2H3,(H,20,22)(H,21,23)