2-ethyl-5-(3-methylbutoxy)isoquinolin-1-one

Systemtic Name: 2-ethyl-5-(3-methylbutoxy)isoquinolin-1-one Openeye Name: 2-ethyl-5-isopentyloxy-isoquinolin-1-one CAS Name: 2-ethyl-5-(3-methylbutoxy)-1-isoquinolinone IUPAC Name: 2-ethyl-5-(3-methylbutoxy)isoquinolin-1-one Traditional Name: 2-ethyl-5-isoamoxy-isocarbostyril Formula: C16H21NO2 MolecularWeight: 259.34344

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC2=C(C1=O)C=CC=C2OCCC(C)C

Isomeric SMILES

CCN1C=CC2=C(C1=O)C=CC=C2OCCC(C)C

InChI

InChI=1S/C16H21NO2/c1-4-17-10-8-13-14(16(17)18)6-5-7-15(13)19-11-9-12(2)3/h5-8,10,12H,4,9,11H2,1-3H3