2-[[2-[2,4-bis(bromanyl)phenoxy]ethanoylamino]carbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: 2-[[2-[2,4-bis(bromanyl)phenoxy]ethanoylamino]carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: 2-[[[2-(2,4-dibromophenoxy)acetyl]amino]carbamoyl]cyclohexanecarboxylic acid CAS Name: 2-[[[2-(2,4-dibromophenoxy)-1-oxoethyl]hydrazo]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 2-[[[2-(2,4-dibromophenoxy)acetyl]amino]carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: 2-[[[2-(2,4-dibromophenoxy)acetyl]amino]carbamoyl]cyclohexanecarboxylic acid Formula: C16H18Br2N2O5 MolecularWeight: 478.13252

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NNC(=O)COC2=C(C=C(C=C2)Br)Br)C(=O)O

Isomeric SMILES

C1CCC(C(C1)C(=O)NNC(=O)COC2=C(C=C(C=C2)Br)Br)C(=O)O

InChI

InChI=1S/C16H18Br2N2O5/c17-9-5-6-13(12(18)7-9)25-8-14(21)19-20-15(22)10-3-1-2-4-11(10)16(23)24/h5-7,10-11H,1-4,8H2,(H,19,21)(H,20,22)(H,23,24)