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

Systemtic Name: 2-[2-(2,5-dimethylphenyl)-5-iodanyl-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(2,5-dimethylphenyl)-5-iodo-1H-indol-3-yl]acetic acid CAS Name: 2-[2-(2,5-dimethylphenyl)-5-iodo-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-(2,5-dimethylphenyl)-5-iodo-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(2,5-dimethylphenyl)-5-iodo-1H-indol-3-yl]acetic acid Formula: C18H16INO2 MolecularWeight: 405.22961

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=C(C3=C(N2)C=CC(=C3)I)CC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=C(C3=C(N2)C=CC(=C3)I)CC(=O)O

InChI

InChI=1S/C18H16INO2/c1-10-3-4-11(2)13(7-10)18-15(9-17(21)22)14-8-12(19)5-6-16(14)20-18/h3-8,20H,9H2,1-2H3,(H,21,22)