3-methylbutyl 4-[4-[2,4-bis(chloranyl)phenoxy]butanoylamino]benzoate

Systemtic Name: 3-methylbutyl 4-[4-[2,4-bis(chloranyl)phenoxy]butanoylamino]benzoate Openeye Name: isopentyl 4-[4-(2,4-dichlorophenoxy)butanoylamino]benzoate CAS Name: 4-[[4-(2,4-dichlorophenoxy)-1-oxobutyl]amino]benzoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 4-[4-(2,4-dichlorophenoxy)butanoylamino]benzoate Traditional Name: 4-[4-(2,4-dichlorophenoxy)butanoylamino]benzoic acid isoamyl ester Formula: C22H25Cl2NO4 MolecularWeight: 438.3442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C1=CC=C(C=C1)NC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C)CCOC(=O)C1=CC=C(C=C1)NC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C22H25Cl2NO4/c1-15(2)11-13-29-22(27)16-5-8-18(9-6-16)25-21(26)4-3-12-28-20-10-7-17(23)14-19(20)24/h5-10,14-15H,3-4,11-13H2,1-2H3,(H,25,26)