2-[6-ethyl-5-oxamoyl-2-phenyl-7-(phenylmethyl)pyrrolo[1,2-b]pyridazin-4-yl]oxyethanoic acid

Systemtic Name: 2-[6-ethyl-5-oxamoyl-2-phenyl-7-(phenylmethyl)pyrrolo[1,2-b]pyridazin-4-yl]oxyethanoic acid Openeye Name: 2-(7-benzyl-6-ethyl-5-oxamoyl-2-phenyl-pyrrolo[1,2-b]pyridazin-4-yl)oxyacetic acid CAS Name: 2-[[6-ethyl-5-oxamoyl-2-phenyl-7-(phenylmethyl)-4-pyrrolo[1,2-b]pyridazinyl]oxy]acetic acid IUPAC Name: 2-(7-benzyl-6-ethyl-5-oxamoyl-2-phenylpyrrolo[1,2-b]pyridazin-4-yl)oxyacetic acid Traditional Name: 2-(7-benzyl-6-ethyl-5-oxamoyl-2-phenyl-pyrrolo[1,2-b]pyridazin-4-yl)oxyacetic acid Formula: C26H23N3O5 MolecularWeight: 457.47792

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N2C(=C1C(=O)C(=O)N)C(=CC(=N2)C3=CC=CC=C3)OCC(=O)O)CC4=CC=CC=C4

Isomeric SMILES

CCC1=C(N2C(=C1C(=O)C(=O)N)C(=CC(=N2)C3=CC=CC=C3)OCC(=O)O)CC4=CC=CC=C4

InChI

InChI=1S/C26H23N3O5/c1-2-18-20(13-16-9-5-3-6-10-16)29-24(23(18)25(32)26(27)33)21(34-15-22(30)31)14-19(28-29)17-11-7-4-8-12-17/h3-12,14H,2,13,15H2,1H3,(H2,27,33)(H,30,31)