5-(2-chloranyl-2-methyl-pentyl)-4-[(4-iodophenyl)methoxy]-1H-pyridazin-6-one

Systemtic Name: 5-(2-chloranyl-2-methyl-pentyl)-4-[(4-iodophenyl)methoxy]-1H-pyridazin-6-one Openeye Name: 5-(2-chloro-2-methyl-pentyl)-4-[(4-iodophenyl)methoxy]-1H-pyridazin-6-one CAS Name: 5-(2-chloro-2-methylpentyl)-4-[(4-iodophenyl)methoxy]-1H-pyridazin-6-one IUPAC Name: 5-(2-chloro-2-methylpentyl)-4-[(4-iodophenyl)methoxy]-1H-pyridazin-6-one Traditional Name: 5-(2-chloro-2-methyl-pentyl)-4-(4-iodobenzyl)oxy-1H-pyridazin-6-one Formula: C17H20ClIN2O2 MolecularWeight: 446.71037

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(CC1=C(C=NNC1=O)OCC2=CC=C(C=C2)I)Cl

Isomeric SMILES

CCCC(C)(CC1=C(C=NNC1=O)OCC2=CC=C(C=C2)I)Cl

InChI

InChI=1S/C17H20ClIN2O2/c1-3-8-17(2,18)9-14-15(10-20-21-16(14)22)23-11-12-4-6-13(19)7-5-12/h4-7,10H,3,8-9,11H2,1-2H3,(H,21,22)