2-[2-ethyl-3-oxamoyl-1-(phenylmethyl)benzo[f]indol-4-yl]oxyethanoic acid

Systemtic Name: 2-[2-ethyl-3-oxamoyl-1-(phenylmethyl)benzo[f]indol-4-yl]oxyethanoic acid Openeye Name: 2-(1-benzyl-2-ethyl-3-oxamoyl-benzo[f]indol-4-yl)oxyacetic acid CAS Name: 2-[[2-ethyl-3-oxamoyl-1-(phenylmethyl)-4-benzo[f]indolyl]oxy]acetic acid IUPAC Name: 2-(1-benzyl-2-ethyl-3-oxamoylbenzo[f]indol-4-yl)oxyacetic acid Traditional Name: 2-(1-benzyl-2-ethyl-3-oxamoyl-benz[f]indol-4-yl)oxyacetic acid Formula: C25H22N2O5 MolecularWeight: 430.45258

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C3=CC=CC=C3C=C2N1CC4=CC=CC=C4)OCC(=O)O)C(=O)C(=O)N

Isomeric SMILES

CCC1=C(C2=C(C3=CC=CC=C3C=C2N1CC4=CC=CC=C4)OCC(=O)O)C(=O)C(=O)N

InChI

InChI=1S/C25H22N2O5/c1-2-18-21(23(30)25(26)31)22-19(27(18)13-15-8-4-3-5-9-15)12-16-10-6-7-11-17(16)24(22)32-14-20(28)29/h3-12H,2,13-14H2,1H3,(H2,26,31)(H,28,29)