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2-[2-ethyl-3-oxamoyl-1-(phenylsulfonyl)indol-4-yl]ethanoic acid

2-[2-ethyl-3-oxamoyl-1-(phenylsulfonyl)indol-4-yl]ethanoic acid

Systemtic Name:2-[2-ethyl-3-oxamoyl-1-(phenylsulfonyl)indol-4-yl]ethanoic acid
Openeye Name:2-[1-(benzenesulfonyl)-2-ethyl-3-oxamoyl-indol-4-yl]acetic acid
CAS Name:2-[1-(benzenesulfonyl)-2-ethyl-3-oxamoyl-4-indolyl]acetic acid
IUPAC Name:2-[1-(benzenesulfonyl)-2-ethyl-3-oxamoylindol-4-yl]acetic acid
Traditional Name:2-(1-besyl-2-ethyl-3-oxamoyl-indol-4-yl)acetic acid
Formula: C20H18N2O6S
MolecularWeight: 414.43172
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C=CC=C2N1S(=O)(=O)C3=CC=CC=C3)CC(=O)O)C(=O)C(=O)N


Isomeric SMILES

CCC1=C(C2=C(C=CC=C2N1S(=O)(=O)C3=CC=CC=C3)CC(=O)O)C(=O)C(=O)N


InChI

InChI=1S/C20H18N2O6S/c1-2-14-18(19(25)20(21)26)17-12(11-16(23)24)7-6-10-15(17)22(14)29(27,28)13-8-4-3-5-9-13/h3-10H,2,11H2,1H3,(H2,21,26)(H,23,24)


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