2-[2-(5-chloranyl-2-ethoxy-phenyl)-5-iodanyl-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[2-(5-chloranyl-2-ethoxy-phenyl)-5-iodanyl-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(5-chloro-2-ethoxy-phenyl)-5-iodo-1H-indol-3-yl]acetic acid CAS Name: 2-[2-(5-chloro-2-ethoxyphenyl)-5-iodo-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-(5-chloro-2-ethoxyphenyl)-5-iodo-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(5-chloro-2-ethoxy-phenyl)-5-iodo-1H-indol-3-yl]acetic acid Formula: C18H15ClINO3 MolecularWeight: 455.67407

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Cl)C2=C(C3=C(N2)C=CC(=C3)I)CC(=O)O

Isomeric SMILES

CCOC1=C(C=C(C=C1)Cl)C2=C(C3=C(N2)C=CC(=C3)I)CC(=O)O

InChI

InChI=1S/C18H15ClINO3/c1-2-24-16-6-3-10(19)7-14(16)18-13(9-17(22)23)12-8-11(20)4-5-15(12)21-18/h3-8,21H,2,9H2,1H3,(H,22,23)