azanium 2-[(4-chloranyl-2-fluoranyl-phenyl)carbamoyl]cyclohexene-1-carboxylate

Systemtic Name: azanium 2-[(4-chloranyl-2-fluoranyl-phenyl)carbamoyl]cyclohexene-1-carboxylate Openeye Name: ammonium 2-[(4-chloro-2-fluoro-phenyl)carbamoyl]cyclohexene-1-carboxylate CAS Name: ammonium 2-[(4-chloro-2-fluoroanilino)-oxomethyl]-1-cyclohexenecarboxylate IUPAC Name: azanium 2-[(4-chloro-2-fluorophenyl)carbamoyl]cyclohexene-1-carboxylate Traditional Name: ammonium 2-[(4-chloro-2-fluoro-phenyl)carbamoyl]cyclohexene-1-carboxylate Formula: C14H16ClFN2O3 MolecularWeight: 314.739843

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=C(C1)C(=O)NC2=C(C=C(C=C2)Cl)F)C(=O)[O-].[NH4+]

Isomeric SMILES

C1CCC(=C(C1)C(=O)NC2=C(C=C(C=C2)Cl)F)C(=O)[O-].[NH4+]

InChI

InChI=1S/C14H13ClFNO3.H3N/c15-8-5-6-12(11(16)7-8)17-13(18)9-3-1-2-4-10(9)14(19)20;/h5-7H,1-4H2,(H,17,18)(H,19,20);1H3