4-chloranyl-5-[methyl-[[3-(5-oxidanylpentoxy)phenyl]methyl]amino]-2-propan-2-yl-pyridazin-3-one

Systemtic Name: 4-chloranyl-5-[methyl-[[3-(5-oxidanylpentoxy)phenyl]methyl]amino]-2-propan-2-yl-pyridazin-3-one Openeye Name: 4-chloro-5-[[3-(5-hydroxypentoxy)phenyl]methyl-methyl-amino]-2-isopropyl-pyridazin-3-one CAS Name: 4-chloro-5-[[3-(5-hydroxypentoxy)phenyl]methyl-methylamino]-2-propan-2-yl-3-pyridazinone IUPAC Name: 4-chloro-5-[[3-(5-hydroxypentoxy)phenyl]methyl-methylamino]-2-propan-2-ylpyridazin-3-one Traditional Name: 4-chloro-5-[[3-(5-hydroxypentoxy)benzyl]-methyl-amino]-2-isopropyl-pyridazin-3-one Formula: C20H28ClN3O3 MolecularWeight: 393.90762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C(=C(C=N1)N(C)CC2=CC(=CC=C2)OCCCCCO)Cl

Isomeric SMILES

CC(C)N1C(=O)C(=C(C=N1)N(C)CC2=CC(=CC=C2)OCCCCCO)Cl

InChI

InChI=1S/C20H28ClN3O3/c1-15(2)24-20(26)19(21)18(13-22-24)23(3)14-16-8-7-9-17(12-16)27-11-6-4-5-10-25/h7-9,12-13,15,25H,4-6,10-11,14H2,1-3H3