2-[2-chloranylethanoyl-(4-chloranyl-2-fluoranyl-5-prop-2-enoxy-phenyl)carbamoyl]cyclohexene-1-carboxylic acid

Systemtic Name: 2-[2-chloranylethanoyl-(4-chloranyl-2-fluoranyl-5-prop-2-enoxy-phenyl)carbamoyl]cyclohexene-1-carboxylic acid Openeye Name: 2-[(5-allyloxy-4-chloro-2-fluoro-phenyl)-(2-chloroacetyl)carbamoyl]cyclohexene-1-carboxylic acid CAS Name: 2-[(4-chloro-N-(2-chloro-1-oxoethyl)-2-fluoro-5-prop-2-enoxyanilino)-oxomethyl]-1-cyclohexenecarboxylic acid IUPAC Name: 2-[(2-chloroacetyl)-(4-chloro-2-fluoro-5-prop-2-enoxyphenyl)carbamoyl]cyclohexene-1-carboxylic acid Traditional Name: 2-[(5-allyloxy-4-chloro-2-fluoro-phenyl)-(2-chloroacetyl)carbamoyl]cyclohexene-1-carboxylic acid Formula: C19H18Cl2FNO5 MolecularWeight: 430.254323

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=C(C=C(C(=C1)N(C(=O)CCl)C(=O)C2=C(CCCC2)C(=O)O)F)Cl

Isomeric SMILES

C=CCOC1=C(C=C(C(=C1)N(C(=O)CCl)C(=O)C2=C(CCCC2)C(=O)O)F)Cl

InChI

InChI=1S/C19H18Cl2FNO5/c1-2-7-28-16-9-15(14(22)8-13(16)21)23(17(24)10-20)18(25)11-5-3-4-6-12(11)19(26)27/h2,8-9H,1,3-7,10H2,(H,26,27)