6,8-bis(oxidanyl)-3-pentyl-2H-isoquinolin-1-one

Systemtic Name: 6,8-bis(oxidanyl)-3-pentyl-2H-isoquinolin-1-one Openeye Name: 6,8-dihydroxy-3-pentyl-2H-isoquinolin-1-one CAS Name: 6,8-dihydroxy-3-pentyl-2H-isoquinolin-1-one IUPAC Name: 6,8-dihydroxy-3-pentyl-2H-isoquinolin-1-one Traditional Name: 3-amyl-6,8-dihydroxy-isocarbostyril Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC2=CC(=CC(=C2C(=O)N1)O)O

Isomeric SMILES

CCCCCC1=CC2=CC(=CC(=C2C(=O)N1)O)O

InChI

InChI=1S/C14H17NO3/c1-2-3-4-5-10-6-9-7-11(16)8-12(17)13(9)14(18)15-10/h6-8,16-17H,2-5H2,1H3,(H,15,18)