4-[3-oxamoyl-1-(phenylmethyl)-2-propyl-indol-4-yl]oxybutanoic acid

Systemtic Name: 4-[3-oxamoyl-1-(phenylmethyl)-2-propyl-indol-4-yl]oxybutanoic acid Openeye Name: 4-(1-benzyl-3-oxamoyl-2-propyl-indol-4-yl)oxybutanoic acid CAS Name: 4-[[3-oxamoyl-1-(phenylmethyl)-2-propyl-4-indolyl]oxy]butanoic acid IUPAC Name: 4-(1-benzyl-3-oxamoyl-2-propylindol-4-yl)oxybutanoic acid Traditional Name: 4-(1-benzyl-3-oxamoyl-2-propyl-indol-4-yl)oxybutyric acid Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=C(N1CC3=CC=CC=C3)C=CC=C2OCCCC(=O)O)C(=O)C(=O)N

Isomeric SMILES

CCCC1=C(C2=C(N1CC3=CC=CC=C3)C=CC=C2OCCCC(=O)O)C(=O)C(=O)N

InChI

InChI=1S/C24H26N2O5/c1-2-8-17-22(23(29)24(25)30)21-18(26(17)15-16-9-4-3-5-10-16)11-6-12-19(21)31-14-7-13-20(27)28/h3-6,9-12H,2,7-8,13-15H2,1H3,(H2,25,30)(H,27,28)