[2-(4-iodophenyl)-2-oxidanylidene-ethyl] 3-(dimethylamino)benzoate

Systemtic Name: [2-(4-iodophenyl)-2-oxidanylidene-ethyl] 3-(dimethylamino)benzoate Openeye Name: [2-(4-iodophenyl)-2-oxo-ethyl] 3-(dimethylamino)benzoate CAS Name: 3-(dimethylamino)benzoic acid [2-(4-iodophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-iodophenyl)-2-oxoethyl] 3-(dimethylamino)benzoate Traditional Name: 3-(dimethylamino)benzoic acid [2-(4-iodophenyl)-2-keto-ethyl] ester Formula: C17H16INO3 MolecularWeight: 409.21831

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC(=C1)C(=O)OCC(=O)C2=CC=C(C=C2)I

Isomeric SMILES

CN(C)C1=CC=CC(=C1)C(=O)OCC(=O)C2=CC=C(C=C2)I

InChI

InChI=1S/C17H16INO3/c1-19(2)15-5-3-4-13(10-15)17(21)22-11-16(20)12-6-8-14(18)9-7-12/h3-10H,11H2,1-2H3