O4-[2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] O1-methyl benzene-1,4-dicarboxylate

Systemtic Name: O4-[2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] O1-methyl benzene-1,4-dicarboxylate Openeye Name: O4-[2-(3-iodoanilino)-2-oxo-ethyl] O1-methyl benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O4-[2-(3-iodoanilino)-2-oxoethyl] ester O1-methyl ester IUPAC Name: 4-O-[2-(3-iodoanilino)-2-oxoethyl] 1-O-methyl benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-[2-(3-iodoanilino)-2-keto-ethyl] ester O1-methyl ester Formula: C17H14INO5 MolecularWeight: 439.20123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)OCC(=O)NC2=CC(=CC=C2)I

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)OCC(=O)NC2=CC(=CC=C2)I

InChI

InChI=1S/C17H14INO5/c1-23-16(21)11-5-7-12(8-6-11)17(22)24-10-15(20)19-14-4-2-3-13(18)9-14/h2-9H,10H2,1H3,(H,19,20)