2-[1-(12-bromanyldodecyl)-2-methyl-3-oxamoyl-indol-4-yl]oxyethanoic acid

Systemtic Name: 2-[1-(12-bromanyldodecyl)-2-methyl-3-oxamoyl-indol-4-yl]oxyethanoic acid Openeye Name: 2-[1-(12-bromododecyl)-2-methyl-3-oxamoyl-indol-4-yl]oxyacetic acid CAS Name: 2-[[1-(12-bromododecyl)-2-methyl-3-oxamoyl-4-indolyl]oxy]acetic acid IUPAC Name: 2-[1-(12-bromododecyl)-2-methyl-3-oxamoylindol-4-yl]oxyacetic acid Traditional Name: 2-[1-(12-bromododecyl)-2-methyl-3-oxamoyl-indol-4-yl]oxyacetic acid Formula: C25H35BrN2O5 MolecularWeight: 523.4598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CCCCCCCCCCCCBr)C=CC=C2OCC(=O)O)C(=O)C(=O)N

Isomeric SMILES

CC1=C(C2=C(N1CCCCCCCCCCCCBr)C=CC=C2OCC(=O)O)C(=O)C(=O)N

InChI

InChI=1S/C25H35BrN2O5/c1-18-22(24(31)25(27)32)23-19(13-12-14-20(23)33-17-21(29)30)28(18)16-11-9-7-5-3-2-4-6-8-10-15-26/h12-14H,2-11,15-17H2,1H3,(H2,27,32)(H,29,30)