3-[4-(3-chlorophenyl)-7-ethyl-2-phenyl-pyrrolo[1,2-b]pyridazin-3-yl]propanoic acid

Systemtic Name: 3-[4-(3-chlorophenyl)-7-ethyl-2-phenyl-pyrrolo[1,2-b]pyridazin-3-yl]propanoic acid Openeye Name: 3-[4-(3-chlorophenyl)-7-ethyl-2-phenyl-pyrrolo[1,2-b]pyridazin-3-yl]propanoic acid CAS Name: 3-[4-(3-chlorophenyl)-7-ethyl-2-phenyl-3-pyrrolo[1,2-b]pyridazinyl]propanoic acid IUPAC Name: 3-[4-(3-chlorophenyl)-7-ethyl-2-phenylpyrrolo[1,2-b]pyridazin-3-yl]propanoic acid Traditional Name: 3-[4-(3-chlorophenyl)-7-ethyl-2-phenyl-pyrrolo[1,2-b]pyridazin-3-yl]propionic acid Formula: C24H21ClN2O2 MolecularWeight: 404.88874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C2N1N=C(C(=C2C3=CC(=CC=C3)Cl)CCC(=O)O)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C2N1N=C(C(=C2C3=CC(=CC=C3)Cl)CCC(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C24H21ClN2O2/c1-2-19-11-13-21-23(17-9-6-10-18(25)15-17)20(12-14-22(28)29)24(26-27(19)21)16-7-4-3-5-8-16/h3-11,13,15H,2,12,14H2,1H3,(H,28,29)