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

Systemtic Name: 2-[2-ethyl-3-oxamoyl-1-(phenylmethyl)indol-4-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-(1-benzyl-2-ethyl-3-oxamoyl-indol-4-yl)-2-oxo-acetic acid CAS Name: 2-[2-ethyl-3-oxamoyl-1-(phenylmethyl)-4-indolyl]-2-oxoacetic acid IUPAC Name: 2-(1-benzyl-2-ethyl-3-oxamoylindol-4-yl)-2-oxoacetic acid Traditional Name: 2-(1-benzyl-2-ethyl-3-oxamoyl-indol-4-yl)-2-keto-acetic acid Formula: C21H18N2O5 MolecularWeight: 378.37802

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C=CC=C2N1CC3=CC=CC=C3)C(=O)C(=O)O)C(=O)C(=O)N

Isomeric SMILES

CCC1=C(C2=C(C=CC=C2N1CC3=CC=CC=C3)C(=O)C(=O)O)C(=O)C(=O)N

InChI

InChI=1S/C21H18N2O5/c1-2-14-17(19(25)20(22)26)16-13(18(24)21(27)28)9-6-10-15(16)23(14)11-12-7-4-3-5-8-12/h3-10H,2,11H2,1H3,(H2,22,26)(H,27,28)