dimethyl 2-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]benzene-1,4-dicarboxylate CAS Name: 2-[[4-(4-chloro-2-methylphenoxy)-1-oxobutyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[4-(4-chloro-2-methylphenoxy)butanoylamino]benzene-1,4-dicarboxylate Traditional Name: 2-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C21H22ClNO6 MolecularWeight: 419.85548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NC2=C(C=CC(=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NC2=C(C=CC(=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C21H22ClNO6/c1-13-11-15(22)7-9-18(13)29-10-4-5-19(24)23-17-12-14(20(25)27-2)6-8-16(17)21(26)28-3/h6-9,11-12H,4-5,10H2,1-3H3,(H,23,24)