2-[5-iodanyl-2-(3-phenoxyphenyl)-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[5-iodanyl-2-(3-phenoxyphenyl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[5-iodo-2-(3-phenoxyphenyl)-1H-indol-3-yl]acetic acid CAS Name: 2-[5-iodo-2-(3-phenoxyphenyl)-1H-indol-3-yl]acetic acid IUPAC Name: 2-[5-iodo-2-(3-phenoxyphenyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[5-iodo-2-(3-phenoxyphenyl)-1H-indol-3-yl]acetic acid Formula: C22H16INO3 MolecularWeight: 469.27181

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)C3=C(C4=C(N3)C=CC(=C4)I)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)C3=C(C4=C(N3)C=CC(=C4)I)CC(=O)O

InChI

InChI=1S/C22H16INO3/c23-15-9-10-20-18(12-15)19(13-21(25)26)22(24-20)14-5-4-8-17(11-14)27-16-6-2-1-3-7-16/h1-12,24H,13H2,(H,25,26)