6-bromanyl-4-butoxy-3-(chloromethyl)-2-(2,2-dimethylpropyl)isoquinolin-1-one

Systemtic Name: 6-bromanyl-4-butoxy-3-(chloromethyl)-2-(2,2-dimethylpropyl)isoquinolin-1-one Openeye Name: 6-bromo-4-butoxy-3-(chloromethyl)-2-(2,2-dimethylpropyl)isoquinolin-1-one CAS Name: 6-bromo-4-butoxy-3-(chloromethyl)-2-(2,2-dimethylpropyl)-1-isoquinolinone IUPAC Name: 6-bromo-4-butoxy-3-(chloromethyl)-2-(2,2-dimethylpropyl)isoquinolin-1-one Traditional Name: 6-bromo-4-butoxy-3-(chloromethyl)-2-neopentyl-isocarbostyril Formula: C19H25BrClNO2 MolecularWeight: 414.7643

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(N(C(=O)C2=C1C=C(C=C2)Br)CC(C)(C)C)CCl

Isomeric SMILES

CCCCOC1=C(N(C(=O)C2=C1C=C(C=C2)Br)CC(C)(C)C)CCl

InChI

InChI=1S/C19H25BrClNO2/c1-5-6-9-24-17-15-10-13(20)7-8-14(15)18(23)22(16(17)11-21)12-19(2,3)4/h7-8,10H,5-6,9,11-12H2,1-4H3