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4-butoxy-6,7-bis(chloranyl)-3-(1-chloranylbutyl)-2-methyl-isoquinolin-1-one

4-butoxy-6,7-bis(chloranyl)-3-(1-chloranylbutyl)-2-methyl-isoquinolin-1-one

Systemtic Name:4-butoxy-6,7-bis(chloranyl)-3-(1-chloranylbutyl)-2-methyl-isoquinolin-1-one
Openeye Name:4-butoxy-6,7-dichloro-3-(1-chlorobutyl)-2-methyl-isoquinolin-1-one
CAS Name:4-butoxy-6,7-dichloro-3-(1-chlorobutyl)-2-methyl-1-isoquinolinone
IUPAC Name:4-butoxy-6,7-dichloro-3-(1-chlorobutyl)-2-methylisoquinolin-1-one
Traditional Name:4-butoxy-6,7-dichloro-3-(1-chlorobutyl)-2-methyl-isocarbostyril
Formula: C18H22Cl3NO2
MolecularWeight: 390.73178
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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(N(C(=O)C2=CC(=C(C=C21)Cl)Cl)C)C(CCC)Cl


Isomeric SMILES

CCCCOC1=C(N(C(=O)C2=CC(=C(C=C21)Cl)Cl)C)C(CCC)Cl


InChI

InChI=1S/C18H22Cl3NO2/c1-4-6-8-24-17-11-9-14(20)15(21)10-12(11)18(23)22(3)16(17)13(19)7-5-2/h9-10,13H,4-8H2,1-3H3


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