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

Systemtic Name: 3-(2,2-dimethylpropyl)-7-ethoxy-3,4-dihydro-2H-isoquinolin-1-one Openeye Name: 3-(2,2-dimethylpropyl)-7-ethoxy-3,4-dihydro-2H-isoquinolin-1-one CAS Name: 3-(2,2-dimethylpropyl)-7-ethoxy-3,4-dihydro-2H-isoquinolin-1-one IUPAC Name: 3-(2,2-dimethylpropyl)-7-ethoxy-3,4-dihydro-2H-isoquinolin-1-one Traditional Name: 7-ethoxy-3-neopentyl-3,4-dihydroisocarbostyril Formula: C16H23NO2 MolecularWeight: 261.35932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(CC(NC2=O)CC(C)(C)C)C=C1

Isomeric SMILES

CCOC1=CC2=C(CC(NC2=O)CC(C)(C)C)C=C1

InChI

InChI=1S/C16H23NO2/c1-5-19-13-7-6-11-8-12(10-16(2,3)4)17-15(18)14(11)9-13/h6-7,9,12H,5,8,10H2,1-4H3,(H,17,18)