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

Systemtic Name: 2-[2-ethyl-3-oxamoyl-1-(phenylmethyl)-6-propan-2-yloxycarbonyl-indol-4-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-(1-benzyl-2-ethyl-6-isopropoxycarbonyl-3-oxamoyl-indol-4-yl)-2-oxo-acetic acid CAS Name: 2-[2-ethyl-3-oxamoyl-6-[oxo(propan-2-yloxy)methyl]-1-(phenylmethyl)-4-indolyl]-2-oxoacetic acid IUPAC Name: 2-(1-benzyl-2-ethyl-3-oxamoyl-6-propan-2-yloxycarbonylindol-4-yl)-2-oxoacetic acid Traditional Name: 2-(1-benzyl-2-ethyl-6-isopropoxycarbonyl-3-oxamoyl-indol-4-yl)-2-keto-acetic acid Formula: C25H24N2O7 MolecularWeight: 464.46726

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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)C)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)C)C(=O)C(=O)O)C(=O)C(=O)N

InChI

InChI=1S/C25H24N2O7/c1-4-17-20(22(29)23(26)30)19-16(21(28)24(31)32)10-15(25(33)34-13(2)3)11-18(19)27(17)12-14-8-6-5-7-9-14/h5-11,13H,4,12H2,1-3H3,(H2,26,30)(H,31,32)