4-[4-[2,4-bis(chloranyl)phenoxy]butanoyl-methyl-amino]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[4-[2,4-bis(chloranyl)phenoxy]butanoyl-methyl-amino]cyclohexane-1-carboxylic acid Openeye Name: 4-[4-(2,4-dichlorophenoxy)butanoyl-methyl-amino]cyclohexanecarboxylic acid CAS Name: 4-[[4-(2,4-dichlorophenoxy)-1-oxobutyl]-methylamino]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[4-(2,4-dichlorophenoxy)butanoyl-methylamino]cyclohexane-1-carboxylic acid Traditional Name: 4-[4-(2,4-dichlorophenoxy)butanoyl-methyl-amino]cyclohexanecarboxylic acid Formula: C18H23Cl2NO4 MolecularWeight: 388.28552

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCC(CC1)C(=O)O)C(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CN(C1CCC(CC1)C(=O)O)C(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C18H23Cl2NO4/c1-21(14-7-4-12(5-8-14)18(23)24)17(22)3-2-10-25-16-9-6-13(19)11-15(16)20/h6,9,11-12,14H,2-5,7-8,10H2,1H3,(H,23,24)