2,3,3-tris(chloranyl)prop-2-enyl 6-[(4-iodophenyl)carbamoyl]cyclohex-3-ene-1-carboxylate

Systemtic Name: 2,3,3-tris(chloranyl)prop-2-enyl 6-[(4-iodophenyl)carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: 2,3,3-trichloroallyl 6-[(4-iodophenyl)carbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: 6-[(4-iodoanilino)-oxomethyl]-1-cyclohex-3-enecarboxylic acid 2,3,3-trichloroprop-2-enyl ester IUPAC Name: 2,3,3-trichloroprop-2-enyl 6-[(4-iodophenyl)carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: 6-[(4-iodophenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid 2,3,3-trichloroallyl ester Formula: C17H15Cl3INO3 MolecularWeight: 514.56937

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC(C1C(=O)NC2=CC=C(C=C2)I)C(=O)OCC(=C(Cl)Cl)Cl

Isomeric SMILES

C1C=CCC(C1C(=O)NC2=CC=C(C=C2)I)C(=O)OCC(=C(Cl)Cl)Cl

InChI

InChI=1S/C17H15Cl3INO3/c18-14(15(19)20)9-25-17(24)13-4-2-1-3-12(13)16(23)22-11-7-5-10(21)6-8-11/h1-2,5-8,12-13H,3-4,9H2,(H,22,23)