2-[2-ethyl-3-[(2-nitrophenyl)methyl]-1-oxamoyl-indolizin-8-yl]oxyethanoic acid

Systemtic Name: 2-[2-ethyl-3-[(2-nitrophenyl)methyl]-1-oxamoyl-indolizin-8-yl]oxyethanoic acid Openeye Name: 2-[2-ethyl-3-[(2-nitrophenyl)methyl]-1-oxamoyl-indolizin-8-yl]oxyacetic acid CAS Name: 2-[[2-ethyl-3-[(2-nitrophenyl)methyl]-1-oxamoyl-8-indolizinyl]oxy]acetic acid IUPAC Name: 2-[2-ethyl-3-[(2-nitrophenyl)methyl]-1-oxamoylindolizin-8-yl]oxyacetic acid Traditional Name: 2-[2-ethyl-3-(2-nitrobenzyl)-1-oxamoyl-indolizin-8-yl]oxyacetic acid Formula: C21H19N3O7 MolecularWeight: 425.39146

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N2C=CC=C(C2=C1C(=O)C(=O)N)OCC(=O)O)CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCC1=C(N2C=CC=C(C2=C1C(=O)C(=O)N)OCC(=O)O)CC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H19N3O7/c1-2-13-15(10-12-6-3-4-7-14(12)24(29)30)23-9-5-8-16(31-11-17(25)26)19(23)18(13)20(27)21(22)28/h3-9H,2,10-11H2,1H3,(H2,22,28)(H,25,26)