dimethyl 2-[2-(3-phenylpropanoyloxy)ethanoylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[2-(3-phenylpropanoyloxy)ethanoylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[2-(3-phenylpropanoyloxy)acetyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[1-oxo-2-(1-oxo-3-phenylpropoxy)ethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[2-(3-phenylpropanoyloxy)acetyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[(2-hydrocinnamoyloxyacetyl)amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C21H21NO7 MolecularWeight: 399.39394

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)COC(=O)CCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)COC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C21H21NO7/c1-27-20(25)15-9-10-16(21(26)28-2)17(12-15)22-18(23)13-29-19(24)11-8-14-6-4-3-5-7-14/h3-7,9-10,12H,8,11,13H2,1-2H3,(H,22,23)