3-phenethyl-2H-isoquinolin-1-one

Systemtic Name: 3-phenethyl-2H-isoquinolin-1-one Openeye Name: 3-phenethyl-2H-isoquinolin-1-one CAS Name: 3-phenethyl-2H-isoquinolin-1-one IUPAC Name: 3-phenethyl-2H-isoquinolin-1-one Traditional Name: 3-phenethylisocarbostyril Formula: C17H15NO MolecularWeight: 249.3071

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=CC3=CC=CC=C3C(=O)N2

Isomeric SMILES

C1=CC=C(C=C1)CCC2=CC3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C17H15NO/c19-17-16-9-5-4-8-14(16)12-15(18-17)11-10-13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,18,19)