2-[2-cyclopropyl-3-oxamoyl-1-(phenylmethyl)indol-4-yl]oxyethanoic acid

Systemtic Name: 2-[2-cyclopropyl-3-oxamoyl-1-(phenylmethyl)indol-4-yl]oxyethanoic acid Openeye Name: 2-(1-benzyl-2-cyclopropyl-3-oxamoyl-indol-4-yl)oxyacetic acid CAS Name: 2-[[2-cyclopropyl-3-oxamoyl-1-(phenylmethyl)-4-indolyl]oxy]acetic acid IUPAC Name: 2-(1-benzyl-2-cyclopropyl-3-oxamoylindol-4-yl)oxyacetic acid Traditional Name: 2-(1-benzyl-2-cyclopropyl-3-oxamoyl-indol-4-yl)oxyacetic acid Formula: C22H20N2O5 MolecularWeight: 392.4046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C(C3=C(N2CC4=CC=CC=C4)C=CC=C3OCC(=O)O)C(=O)C(=O)N

Isomeric SMILES

C1CC1C2=C(C3=C(N2CC4=CC=CC=C4)C=CC=C3OCC(=O)O)C(=O)C(=O)N

InChI

InChI=1S/C22H20N2O5/c23-22(28)21(27)19-18-15(7-4-8-16(18)29-12-17(25)26)24(20(19)14-9-10-14)11-13-5-2-1-3-6-13/h1-8,14H,9-12H2,(H2,23,28)(H,25,26)