2-[(5-chloranyl-2-iodanyl-phenyl)amino]pent-4-enoic acid

Systemtic Name: 2-[(5-chloranyl-2-iodanyl-phenyl)amino]pent-4-enoic acid Openeye Name: 2-(5-chloro-2-iodo-anilino)pent-4-enoic acid CAS Name: 2-(5-chloro-2-iodoanilino)-4-pentenoic acid IUPAC Name: 2-(5-chloro-2-iodoanilino)pent-4-enoic acid Traditional Name: 2-(5-chloro-2-iodo-anilino)pent-4-enoic acid Formula: C11H11ClINO2 MolecularWeight: 351.56801

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(C(=O)O)NC1=C(C=CC(=C1)Cl)I

Isomeric SMILES

C=CCC(C(=O)O)NC1=C(C=CC(=C1)Cl)I

InChI

InChI=1S/C11H11ClINO2/c1-2-3-9(11(15)16)14-10-6-7(12)4-5-8(10)13/h2,4-6,9,14H,1,3H2,(H,15,16)