2-[2-ethyl-6-methoxycarbonyl-3-oxamoyl-1-(phenylmethyl)indol-4-yl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[2-ethyl-6-methoxycarbonyl-3-oxamoyl-1-(phenylmethyl)indol-4-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-(1-benzyl-2-ethyl-6-methoxycarbonyl-3-oxamoyl-indol-4-yl)-2-oxo-acetic acid CAS Name: 2-[2-ethyl-6-methoxycarbonyl-3-oxamoyl-1-(phenylmethyl)-4-indolyl]-2-oxoacetic acid IUPAC Name: 2-(1-benzyl-2-ethyl-6-methoxycarbonyl-3-oxamoylindol-4-yl)-2-oxoacetic acid Traditional Name: 2-(1-benzyl-6-carbomethoxy-2-ethyl-3-oxamoyl-indol-4-yl)-2-keto-acetic acid Formula: C23H20N2O7 MolecularWeight: 436.4141

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20N2O7/c1-3-15-18(20(27)21(24)28)17-14(19(26)22(29)30)9-13(23(31)32-2)10-16(17)25(15)11-12-7-5-4-6-8-12/h4-10H,3,11H2,1-2H3,(H2,24,28)(H,29,30)