3-(2,2-dimethylpropyl)-6-propoxy-3,4-dihydro-2H-isoquinolin-1-one

Systemtic Name: 3-(2,2-dimethylpropyl)-6-propoxy-3,4-dihydro-2H-isoquinolin-1-one Openeye Name: 3-(2,2-dimethylpropyl)-6-propoxy-3,4-dihydro-2H-isoquinolin-1-one CAS Name: 3-(2,2-dimethylpropyl)-6-propoxy-3,4-dihydro-2H-isoquinolin-1-one IUPAC Name: 3-(2,2-dimethylpropyl)-6-propoxy-3,4-dihydro-2H-isoquinolin-1-one Traditional Name: 3-neopentyl-6-propoxy-3,4-dihydroisocarbostyril Formula: C17H25NO2 MolecularWeight: 275.3859

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=C(C=C1)C(=O)NC(C2)CC(C)(C)C

Isomeric SMILES

CCCOC1=CC2=C(C=C1)C(=O)NC(C2)CC(C)(C)C

InChI

InChI=1S/C17H25NO2/c1-5-8-20-14-6-7-15-12(10-14)9-13(18-16(15)19)11-17(2,3)4/h6-7,10,13H,5,8-9,11H2,1-4H3,(H,18,19)