dimethyl 5-[3-(3,4-dimethoxyphenyl)propanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[3-(3,4-dimethoxyphenyl)propanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[3-(3,4-dimethoxyphenyl)propanoylamino]benzene-1,3-dicarboxylate CAS Name: 5-[[3-(3,4-dimethoxyphenyl)-1-oxopropyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[3-(3,4-dimethoxyphenyl)propanoylamino]benzene-1,3-dicarboxylate Traditional Name: 5-[3-(3,4-dimethoxyphenyl)propanoylamino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C21H23NO7 MolecularWeight: 401.40982

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)OC

InChI

InChI=1S/C21H23NO7/c1-26-17-7-5-13(9-18(17)27-2)6-8-19(23)22-16-11-14(20(24)28-3)10-15(12-16)21(25)29-4/h5,7,9-12H,6,8H2,1-4H3,(H,22,23)