4-butoxy-6-chloranyl-3-(chloromethyl)-2-propyl-isoquinolin-1-one

Systemtic Name: 4-butoxy-6-chloranyl-3-(chloromethyl)-2-propyl-isoquinolin-1-one Openeye Name: 4-butoxy-6-chloro-3-(chloromethyl)-2-propyl-isoquinolin-1-one CAS Name: 4-butoxy-6-chloro-3-(chloromethyl)-2-propyl-1-isoquinolinone IUPAC Name: 4-butoxy-6-chloro-3-(chloromethyl)-2-propylisoquinolin-1-one Traditional Name: 4-butoxy-6-chloro-3-(chloromethyl)-2-propyl-isocarbostyril Formula: C17H21Cl2NO2 MolecularWeight: 342.26014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(N(C(=O)C2=C1C=C(C=C2)Cl)CCC)CCl

Isomeric SMILES

CCCCOC1=C(N(C(=O)C2=C1C=C(C=C2)Cl)CCC)CCl

InChI

InChI=1S/C17H21Cl2NO2/c1-3-5-9-22-16-14-10-12(19)6-7-13(14)17(21)20(8-4-2)15(16)11-18/h6-7,10H,3-5,8-9,11H2,1-2H3