5-[4-(2-chloranylpyridin-4-yl)-7-ethyl-2-methyl-pyrrolo[1,2-b]pyridazin-3-yl]pentanoic acid

Systemtic Name: 5-[4-(2-chloranylpyridin-4-yl)-7-ethyl-2-methyl-pyrrolo[1,2-b]pyridazin-3-yl]pentanoic acid Openeye Name: 5-[4-(2-chloro-4-pyridyl)-7-ethyl-2-methyl-pyrrolo[1,2-b]pyridazin-3-yl]pentanoic acid CAS Name: 5-[4-(2-chloro-4-pyridinyl)-7-ethyl-2-methyl-3-pyrrolo[1,2-b]pyridazinyl]pentanoic acid IUPAC Name: 5-[4-(2-chloropyridin-4-yl)-7-ethyl-2-methylpyrrolo[1,2-b]pyridazin-3-yl]pentanoic acid Traditional Name: 5-[4-(2-chloro-4-pyridyl)-7-ethyl-2-methyl-pyrrolo[1,2-b]pyridazin-3-yl]valeric acid Formula: C20H22ClN3O2 MolecularWeight: 371.86058

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C2N1N=C(C(=C2C3=CC(=NC=C3)Cl)CCCCC(=O)O)C

Isomeric SMILES

CCC1=CC=C2N1N=C(C(=C2C3=CC(=NC=C3)Cl)CCCCC(=O)O)C

InChI

InChI=1S/C20H22ClN3O2/c1-3-15-8-9-17-20(14-10-11-22-18(21)12-14)16(13(2)23-24(15)17)6-4-5-7-19(25)26/h8-12H,3-7H2,1-2H3,(H,25,26)