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

Systemtic Name: dimethyl 2-[4-(4-chloranylphenoxy)butanoylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[4-(4-chlorophenoxy)butanoylamino]benzene-1,4-dicarboxylate CAS Name: 2-[[4-(4-chlorophenoxy)-1-oxobutyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[4-(4-chlorophenoxy)butanoylamino]benzene-1,4-dicarboxylate Traditional Name: 2-[4-(4-chlorophenoxy)butanoylamino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C20H20ClNO6 MolecularWeight: 405.8289

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)CCCOC2=CC=C(C=C2)Cl

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)CCCOC2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H20ClNO6/c1-26-19(24)13-5-10-16(20(25)27-2)17(12-13)22-18(23)4-3-11-28-15-8-6-14(21)7-9-15/h5-10,12H,3-4,11H2,1-2H3,(H,22,23)