(2E)-2-(5-chloranyl-2-iodanyl-1-phenyl-pyrrolidin-3-ylidene)butanoic acid

Systemtic Name: (2E)-2-(5-chloranyl-2-iodanyl-1-phenyl-pyrrolidin-3-ylidene)butanoic acid Openeye Name: (2E)-2-(5-chloro-2-iodo-1-phenyl-pyrrolidin-3-ylidene)butanoic acid CAS Name: (2E)-2-(5-chloro-2-iodo-1-phenyl-3-pyrrolidinylidene)butanoic acid IUPAC Name: (2E)-2-(5-chloro-2-iodo-1-phenylpyrrolidin-3-ylidene)butanoic acid Traditional Name: (2E)-2-(5-chloro-2-iodo-1-phenyl-pyrrolidin-3-ylidene)butyric acid Formula: C14H15ClINO2 MolecularWeight: 391.63187

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1CC(N(C1I)C2=CC=CC=C2)Cl)C(=O)O

Isomeric SMILES

CC/C(=C\1/CC(N(C1I)C2=CC=CC=C2)Cl)/C(=O)O

InChI

InChI=1S/C14H15ClINO2/c1-2-10(14(18)19)11-8-12(15)17(13(11)16)9-6-4-3-5-7-9/h3-7,12-13H,2,8H2,1H3,(H,18,19)/b11-10+