methyl (2E)-4-(2-chlorophenyl)-2-(iodanylmethylidene)-4-oxidanyl-butanoate

Systemtic Name: methyl (2E)-4-(2-chlorophenyl)-2-(iodanylmethylidene)-4-oxidanyl-butanoate Openeye Name: methyl (2E)-4-(2-chlorophenyl)-4-hydroxy-2-(iodomethylene)butanoate CAS Name: (2E)-4-(2-chlorophenyl)-4-hydroxy-2-(iodomethylidene)butanoic acid methyl ester IUPAC Name: methyl (2E)-4-(2-chlorophenyl)-4-hydroxy-2-(iodomethylidene)butanoate Traditional Name: (E)-2-[2-(2-chlorophenyl)-2-hydroxy-ethyl]-3-iodo-acrylic acid methyl ester Formula: C12H12ClIO3 MolecularWeight: 366.57935

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CI)CC(C1=CC=CC=C1Cl)O

Isomeric SMILES

COC(=O)/C(=C/I)/CC(C1=CC=CC=C1Cl)O

InChI

InChI=1S/C12H12ClIO3/c1-17-12(16)8(7-14)6-11(15)9-4-2-3-5-10(9)13/h2-5,7,11,15H,6H2,1H3/b8-7+