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

Systemtic Name: 4-butoxy-6,7-bis(chloranyl)-2-methyl-3-(3-methyl-1-oxidanyl-butyl)isoquinolin-1-one Openeye Name: 4-butoxy-6,7-dichloro-3-(1-hydroxy-3-methyl-butyl)-2-methyl-isoquinolin-1-one CAS Name: 4-butoxy-6,7-dichloro-3-(1-hydroxy-3-methylbutyl)-2-methyl-1-isoquinolinone IUPAC Name: 4-butoxy-6,7-dichloro-3-(1-hydroxy-3-methylbutyl)-2-methylisoquinolin-1-one Traditional Name: 4-butoxy-6,7-dichloro-3-(1-hydroxy-3-methyl-butyl)-2-methyl-isocarbostyril Formula: C19H25Cl2NO3 MolecularWeight: 386.3127

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25Cl2NO3/c1-5-6-7-25-18-12-9-14(20)15(21)10-13(12)19(24)22(4)17(18)16(23)8-11(2)3/h9-11,16,23H,5-8H2,1-4H3