3-(2,2-dimethylpropyl)-7-(2-methylpropoxy)-3,4-dihydro-2H-isoquinolin-1-one

Systemtic Name: 3-(2,2-dimethylpropyl)-7-(2-methylpropoxy)-3,4-dihydro-2H-isoquinolin-1-one Openeye Name: 3-(2,2-dimethylpropyl)-7-isobutoxy-3,4-dihydro-2H-isoquinolin-1-one CAS Name: 3-(2,2-dimethylpropyl)-7-(2-methylpropoxy)-3,4-dihydro-2H-isoquinolin-1-one IUPAC Name: 3-(2,2-dimethylpropyl)-7-(2-methylpropoxy)-3,4-dihydro-2H-isoquinolin-1-one Traditional Name: 7-isobutoxy-3-neopentyl-3,4-dihydroisocarbostyril Formula: C18H27NO2 MolecularWeight: 289.41248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC2=C(CC(NC2=O)CC(C)(C)C)C=C1

Isomeric SMILES

CC(C)COC1=CC2=C(CC(NC2=O)CC(C)(C)C)C=C1

InChI

InChI=1S/C18H27NO2/c1-12(2)11-21-15-7-6-13-8-14(10-18(3,4)5)19-17(20)16(13)9-15/h6-7,9,12,14H,8,10-11H2,1-5H3,(H,19,20)