O1-methyl O4-[2-[4-(2-methylpropanoylamino)phenyl]-2-oxidanylidene-ethyl] benzene-1,4-dicarboxylate

Systemtic Name: O1-methyl O4-[2-[4-(2-methylpropanoylamino)phenyl]-2-oxidanylidene-ethyl] benzene-1,4-dicarboxylate Openeye Name: O1-methyl O4-[2-[4-(2-methylpropanoylamino)phenyl]-2-oxo-ethyl] benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O1-methyl ester O4-[2-[4-[(2-methyl-1-oxopropyl)amino]phenyl]-2-oxoethyl] ester IUPAC Name: 1-O-methyl 4-O-[2-[4-(2-methylpropanoylamino)phenyl]-2-oxoethyl] benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-[2-[4-(isobutyrylamino)phenyl]-2-keto-ethyl] ester O1-methyl ester Formula: C21H21NO6 MolecularWeight: 383.39454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C21H21NO6/c1-13(2)19(24)22-17-10-8-14(9-11-17)18(23)12-28-21(26)16-6-4-15(5-7-16)20(25)27-3/h4-11,13H,12H2,1-3H3,(H,22,24)