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

Systemtic Name: 2,3,3-tris(chloranyl)prop-2-enyl 4-[(4-iodophenyl)amino]-4-oxidanylidene-butanoate Openeye Name: 2,3,3-trichloroallyl 4-(4-iodoanilino)-4-oxo-butanoate CAS Name: 4-(4-iodoanilino)-4-oxobutanoic acid 2,3,3-trichloroprop-2-enyl ester IUPAC Name: 2,3,3-trichloroprop-2-enyl 4-(4-iodoanilino)-4-oxobutanoate Traditional Name: 4-(4-iodoanilino)-4-keto-butyric acid 2,3,3-trichloroallyl ester Formula: C13H11Cl3INO3 MolecularWeight: 462.49481

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11Cl3INO3/c14-10(13(15)16)7-21-12(20)6-5-11(19)18-9-3-1-8(17)2-4-9/h1-4H,5-7H2,(H,18,19)