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2-octan-3-ylisoquinolin-1-one

2-octan-3-ylisoquinolin-1-one

Systemtic Name:2-octan-3-ylisoquinolin-1-one
Openeye Name:2-(1-ethylhexyl)isoquinolin-1-one
CAS Name:2-octan-3-yl-1-isoquinolinone
IUPAC Name:2-octan-3-ylisoquinolin-1-one
Traditional Name:2-(1-ethylhexyl)isocarbostyril
Formula: C17H23NO
MolecularWeight: 257.37062
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)N1C=CC2=CC=CC=C2C1=O


Isomeric SMILES

CCCCCC(CC)N1C=CC2=CC=CC=C2C1=O


InChI

InChI=1S/C17H23NO/c1-3-5-6-10-15(4-2)18-13-12-14-9-7-8-11-16(14)17(18)19/h7-9,11-13,15H,3-6,10H2,1-2H3


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