2,3,3-tris(chloranyl)prop-2-enyl 5-[(4-iodophenyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: 2,3,3-tris(chloranyl)prop-2-enyl 5-[(4-iodophenyl)amino]-5-oxidanylidene-pentanoate Openeye Name: 2,3,3-trichloroallyl 5-(4-iodoanilino)-5-oxo-pentanoate CAS Name: 5-(4-iodoanilino)-5-oxopentanoic acid 2,3,3-trichloroprop-2-enyl ester IUPAC Name: 2,3,3-trichloroprop-2-enyl 5-(4-iodoanilino)-5-oxopentanoate Traditional Name: 5-(4-iodoanilino)-5-keto-valeric acid 2,3,3-trichloroallyl ester Formula: C14H13Cl3INO3 MolecularWeight: 476.52139

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CCCC(=O)OCC(=C(Cl)Cl)Cl)I

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CCCC(=O)OCC(=C(Cl)Cl)Cl)I

InChI

InChI=1S/C14H13Cl3INO3/c15-11(14(16)17)8-22-13(21)3-1-2-12(20)19-10-6-4-9(18)5-7-10/h4-7H,1-3,8H2,(H,19,20)