6-[[2-bromanyl-4,6-bis(fluoranyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[[2-bromanyl-4,6-bis(fluoranyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[(2-bromo-4,6-difluoro-phenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[(2-bromo-4,6-difluoroanilino)-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[(2-bromo-4,6-difluorophenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[(2-bromo-4,6-difluoro-phenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C14H12BrF2NO3 MolecularWeight: 360.150786

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC(C1C(=O)NC2=C(C=C(C=C2Br)F)F)C(=O)O

Isomeric SMILES

C1C=CCC(C1C(=O)NC2=C(C=C(C=C2Br)F)F)C(=O)O

InChI

InChI=1S/C14H12BrF2NO3/c15-10-5-7(16)6-11(17)12(10)18-13(19)8-3-1-2-4-9(8)14(20)21/h1-2,5-6,8-9H,3-4H2,(H,18,19)(H,20,21)