5-(hydroxymethyl)-2-propan-2-yl-3,4-dihydroisoquinolin-1-one

Systemtic Name: 5-(hydroxymethyl)-2-propan-2-yl-3,4-dihydroisoquinolin-1-one Openeye Name: 5-(hydroxymethyl)-2-isopropyl-3,4-dihydroisoquinolin-1-one CAS Name: 5-(hydroxymethyl)-2-propan-2-yl-3,4-dihydroisoquinolin-1-one IUPAC Name: 5-(hydroxymethyl)-2-propan-2-yl-3,4-dihydroisoquinolin-1-one Traditional Name: 2-isopropyl-5-methylol-3,4-dihydroisocarbostyril Formula: C13H17NO2 MolecularWeight: 219.27958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC2=C(C1=O)C=CC=C2CO

Isomeric SMILES

CC(C)N1CCC2=C(C1=O)C=CC=C2CO

InChI

InChI=1S/C13H17NO2/c1-9(2)14-7-6-11-10(8-15)4-3-5-12(11)13(14)16/h3-5,9,15H,6-8H2,1-2H3