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

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

Systemtic Name:6-bromanyl-4-butoxy-3-(chloromethyl)-2-(cyclopropylmethyl)isoquinolin-1-one
Openeye Name:6-bromo-4-butoxy-3-(chloromethyl)-2-(cyclopropylmethyl)isoquinolin-1-one
CAS Name:6-bromo-4-butoxy-3-(chloromethyl)-2-(cyclopropylmethyl)-1-isoquinolinone
IUPAC Name:6-bromo-4-butoxy-3-(chloromethyl)-2-(cyclopropylmethyl)isoquinolin-1-one
Traditional Name:6-bromo-4-butoxy-3-(chloromethyl)-2-(cyclopropylmethyl)isocarbostyril
Formula: C18H21BrClNO2
MolecularWeight: 398.72184
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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(N(C(=O)C2=C1C=C(C=C2)Br)CC3CC3)CCl


Isomeric SMILES

CCCCOC1=C(N(C(=O)C2=C1C=C(C=C2)Br)CC3CC3)CCl


InChI

InChI=1S/C18H21BrClNO2/c1-2-3-8-23-17-15-9-13(19)6-7-14(15)18(22)21(16(17)10-20)11-12-4-5-12/h6-7,9,12H,2-5,8,10-11H2,1H3


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