2-[2-ethyl-3-oxamoyl-1-[[2-(phenylmethyl)phenyl]methyl]indol-4-yl]oxyethanoic acid

Systemtic Name: 2-[2-ethyl-3-oxamoyl-1-[[2-(phenylmethyl)phenyl]methyl]indol-4-yl]oxyethanoic acid Openeye Name: 2-[1-[(2-benzylphenyl)methyl]-2-ethyl-3-oxamoyl-indol-4-yl]oxyacetic acid CAS Name: 2-[[2-ethyl-3-oxamoyl-1-[[2-(phenylmethyl)phenyl]methyl]-4-indolyl]oxy]acetic acid IUPAC Name: 2-[1-[(2-benzylphenyl)methyl]-2-ethyl-3-oxamoylindol-4-yl]oxyacetic acid Traditional Name: 2-[1-(2-benzylbenzyl)-2-ethyl-3-oxamoyl-indol-4-yl]oxyacetic acid Formula: C28H26N2O5 MolecularWeight: 470.51644

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(N1CC3=CC=CC=C3CC4=CC=CC=C4)C=CC=C2OCC(=O)O)C(=O)C(=O)N

Isomeric SMILES

CCC1=C(C2=C(N1CC3=CC=CC=C3CC4=CC=CC=C4)C=CC=C2OCC(=O)O)C(=O)C(=O)N

InChI

InChI=1S/C28H26N2O5/c1-2-21-26(27(33)28(29)34)25-22(13-8-14-23(25)35-17-24(31)32)30(21)16-20-12-7-6-11-19(20)15-18-9-4-3-5-10-18/h3-14H,2,15-17H2,1H3,(H2,29,34)(H,31,32)