sodium 2-[2-ethyl-3-oxamoyl-1-[(2-phenylphenyl)methyl]indol-4-yl]oxyethanoate

Systemtic Name: sodium 2-[2-ethyl-3-oxamoyl-1-[(2-phenylphenyl)methyl]indol-4-yl]oxyethanoate Openeye Name: sodium 2-[2-ethyl-3-oxamoyl-1-[(2-phenylphenyl)methyl]indol-4-yl]oxyacetate CAS Name: sodium 2-[[2-ethyl-3-oxamoyl-1-[(2-phenylphenyl)methyl]-4-indolyl]oxy]acetate IUPAC Name: sodium 2-[2-ethyl-3-oxamoyl-1-[(2-phenylphenyl)methyl]indol-4-yl]oxyacetate Traditional Name: sodium 2-[2-ethyl-3-oxamoyl-1-(2-phenylbenzyl)indol-4-yl]oxyacetate Formula: C27H23N2NaO5 MolecularWeight: 478.47169

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(N1CC3=CC=CC=C3C4=CC=CC=C4)C=CC=C2OCC(=O)[O-])C(=O)C(=O)N.[Na+]

Isomeric SMILES

CCC1=C(C2=C(N1CC3=CC=CC=C3C4=CC=CC=C4)C=CC=C2OCC(=O)[O-])C(=O)C(=O)N.[Na+]

InChI

InChI=1S/C27H24N2O5.Na/c1-2-20-25(26(32)27(28)33)24-21(13-8-14-22(24)34-16-23(30)31)29(20)15-18-11-6-7-12-19(18)17-9-4-3-5-10-17;/h3-14H,2,15-16H2,1H3,(H2,28,33)(H,30,31);/q;+1/p-1