2-[2-(3,4-dimethoxyphenyl)-5-iodanyl-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)-5-iodanyl-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(3,4-dimethoxyphenyl)-5-iodo-1H-indol-3-yl]acetic acid CAS Name: 2-[2-(3,4-dimethoxyphenyl)-5-iodo-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)-5-iodo-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(3,4-dimethoxyphenyl)-5-iodo-1H-indol-3-yl]acetic acid Formula: C18H16INO4 MolecularWeight: 437.22841

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)I)CC(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)I)CC(=O)O)OC

InChI

InChI=1S/C18H16INO4/c1-23-15-6-3-10(7-16(15)24-2)18-13(9-17(21)22)12-8-11(19)4-5-14(12)20-18/h3-8,20H,9H2,1-2H3,(H,21,22)