3-bromanyl-4-[[1-[(4-phenoxyphenyl)methyl]-2,3-dihydroindol-5-yl]oxy]benzoic acid

Systemtic Name: 3-bromanyl-4-[[1-[(4-phenoxyphenyl)methyl]-2,3-dihydroindol-5-yl]oxy]benzoic acid Openeye Name: 3-bromo-4-[1-[(4-phenoxyphenyl)methyl]indolin-5-yl]oxy-benzoic acid CAS Name: 3-bromo-4-[[1-[(4-phenoxyphenyl)methyl]-2,3-dihydroindol-5-yl]oxy]benzoic acid IUPAC Name: 3-bromo-4-[[1-[(4-phenoxyphenyl)methyl]-2,3-dihydroindol-5-yl]oxy]benzoic acid Traditional Name: 3-bromo-4-[1-(4-phenoxybenzyl)indolin-5-yl]oxy-benzoic acid Formula: C28H22BrNO4 MolecularWeight: 516.38258

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=C1C=C(C=C2)OC3=C(C=C(C=C3)C(=O)O)Br)CC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

C1CN(C2=C1C=C(C=C2)OC3=C(C=C(C=C3)C(=O)O)Br)CC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C28H22BrNO4/c29-25-17-21(28(31)32)8-13-27(25)34-24-11-12-26-20(16-24)14-15-30(26)18-19-6-9-23(10-7-19)33-22-4-2-1-3-5-22/h1-13,16-17H,14-15,18H2,(H,31,32)