3,5-bis[4-[2,4-bis(chloranyl)phenoxy]butanoylamino]benzoate

Systemtic Name: 3,5-bis[4-[2,4-bis(chloranyl)phenoxy]butanoylamino]benzoate Openeye Name: 3,5-bis[4-(2,4-dichlorophenoxy)butanoylamino]benzoate CAS Name: 3,5-bis[[4-(2,4-dichlorophenoxy)-1-oxobutyl]amino]benzoate IUPAC Name: 3,5-bis[4-(2,4-dichlorophenoxy)butanoylamino]benzoate Traditional Name: 3,5-bis[4-(2,4-dichlorophenoxy)butanoylamino]benzoate Formula: C27H23Cl4N2O6- MolecularWeight: 613.29332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)NC2=CC(=CC(=C2)C(=O)[O-])NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)NC2=CC(=CC(=C2)C(=O)[O-])NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C27H24Cl4N2O6/c28-17-5-7-23(21(30)13-17)38-9-1-3-25(34)32-19-11-16(27(36)37)12-20(15-19)33-26(35)4-2-10-39-24-8-6-18(29)14-22(24)31/h5-8,11-15H,1-4,9-10H2,(H,32,34)(H,33,35)(H,36,37)/p-1