2-[6-(cyclohexylmethyl)-3-methyl-8-oxamoyl-7-propyl-pyrrolo[1,2-a]pyrazin-1-yl]oxyethanoic acid

Systemtic Name: 2-[6-(cyclohexylmethyl)-3-methyl-8-oxamoyl-7-propyl-pyrrolo[1,2-a]pyrazin-1-yl]oxyethanoic acid Openeye Name: 2-[6-(cyclohexylmethyl)-3-methyl-8-oxamoyl-7-propyl-pyrrolo[1,2-a]pyrazin-1-yl]oxyacetic acid CAS Name: 2-[[6-(cyclohexylmethyl)-3-methyl-8-oxamoyl-7-propyl-1-pyrrolo[1,2-a]pyrazinyl]oxy]acetic acid IUPAC Name: 2-[6-(cyclohexylmethyl)-3-methyl-8-oxamoyl-7-propylpyrrolo[1,2-a]pyrazin-1-yl]oxyacetic acid Traditional Name: 2-[6-(cyclohexylmethyl)-3-methyl-8-oxamoyl-7-propyl-pyrrolo[1,2-a]pyrazin-1-yl]oxyacetic acid Formula: C22H29N3O5 MolecularWeight: 415.48276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N2C=C(N=C(C2=C1C(=O)C(=O)N)OCC(=O)O)C)CC3CCCCC3

Isomeric SMILES

CCCC1=C(N2C=C(N=C(C2=C1C(=O)C(=O)N)OCC(=O)O)C)CC3CCCCC3

InChI

InChI=1S/C22H29N3O5/c1-3-7-15-16(10-14-8-5-4-6-9-14)25-11-13(2)24-22(30-12-17(26)27)19(25)18(15)20(28)21(23)29/h11,14H,3-10,12H2,1-2H3,(H2,23,29)(H,26,27)