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

Systemtic Name: sodium 2-[1-[(3-chlorophenyl)methyl]-2-ethyl-3-oxamoyl-indol-4-yl]oxyethanoate Openeye Name: sodium 2-[1-[(3-chlorophenyl)methyl]-2-ethyl-3-oxamoyl-indol-4-yl]oxyacetate CAS Name: sodium 2-[[1-[(3-chlorophenyl)methyl]-2-ethyl-3-oxamoyl-4-indolyl]oxy]acetate IUPAC Name: sodium 2-[1-[(3-chlorophenyl)methyl]-2-ethyl-3-oxamoylindol-4-yl]oxyacetate Traditional Name: sodium 2-[1-(3-chlorobenzyl)-2-ethyl-3-oxamoyl-indol-4-yl]oxyacetate Formula: C21H18ClN2NaO5 MolecularWeight: 436.82079

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(N1CC3=CC(=CC=C3)Cl)C=CC=C2OCC(=O)[O-])C(=O)C(=O)N.[Na+]

Isomeric SMILES

CCC1=C(C2=C(N1CC3=CC(=CC=C3)Cl)C=CC=C2OCC(=O)[O-])C(=O)C(=O)N.[Na+]

InChI

InChI=1S/C21H19ClN2O5.Na/c1-2-14-19(20(27)21(23)28)18-15(7-4-8-16(18)29-11-17(25)26)24(14)10-12-5-3-6-13(22)9-12;/h3-9H,2,10-11H2,1H3,(H2,23,28)(H,25,26);/q;+1/p-1