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

Systemtic Name: O1-methyl O4-[2-oxidanylidene-2-[(2-propan-2-ylphenyl)amino]ethyl] benzene-1,4-dicarboxylate Openeye Name: O4-[2-(2-isopropylanilino)-2-oxo-ethyl] O1-methyl benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O1-methyl ester O4-[2-oxo-2-(2-propan-2-ylanilino)ethyl] ester IUPAC Name: 1-O-methyl 4-O-[2-oxo-2-(2-propan-2-ylanilino)ethyl] benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-[2-(2-isopropylanilino)-2-keto-ethyl] ester O1-methyl ester Formula: C20H21NO5 MolecularWeight: 355.38444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=O)COC(=O)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=O)COC(=O)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C20H21NO5/c1-13(2)16-6-4-5-7-17(16)21-18(22)12-26-20(24)15-10-8-14(9-11-15)19(23)25-3/h4-11,13H,12H2,1-3H3,(H,21,22)