dimethyl 2-[2-(3,4-dimethylphenoxy)butanoylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[2-(3,4-dimethylphenoxy)butanoylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[2-(3,4-dimethylphenoxy)butanoylamino]benzene-1,4-dicarboxylate CAS Name: 2-[[2-(3,4-dimethylphenoxy)-1-oxobutyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[2-(3,4-dimethylphenoxy)butanoylamino]benzene-1,4-dicarboxylate Traditional Name: 2-[2-(3,4-dimethylphenoxy)butanoylamino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C22H25NO6 MolecularWeight: 399.437

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=CC(=C1)C(=O)OC)C(=O)OC)OC2=CC(=C(C=C2)C)C

Isomeric SMILES

CCC(C(=O)NC1=C(C=CC(=C1)C(=O)OC)C(=O)OC)OC2=CC(=C(C=C2)C)C

InChI

InChI=1S/C22H25NO6/c1-6-19(29-16-9-7-13(2)14(3)11-16)20(24)23-18-12-15(21(25)27-4)8-10-17(18)22(26)28-5/h7-12,19H,6H2,1-5H3,(H,23,24)