4-(dimethylaminomethyl)-3-ethyl-7-fluoranyl-2H-isoquinolin-1-one

Systemtic Name: 4-(dimethylaminomethyl)-3-ethyl-7-fluoranyl-2H-isoquinolin-1-one Openeye Name: 4-(dimethylaminomethyl)-3-ethyl-7-fluoro-2H-isoquinolin-1-one CAS Name: 4-(dimethylaminomethyl)-3-ethyl-7-fluoro-2H-isoquinolin-1-one IUPAC Name: 4-(dimethylaminomethyl)-3-ethyl-7-fluoro-2H-isoquinolin-1-one Traditional Name: 4-(dimethylaminomethyl)-3-ethyl-7-fluoro-isocarbostyril Formula: C14H17FN2O MolecularWeight: 248.295983

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C=C(C=C2)F)C(=O)N1)CN(C)C

Isomeric SMILES

CCC1=C(C2=C(C=C(C=C2)F)C(=O)N1)CN(C)C

InChI

InChI=1S/C14H17FN2O/c1-4-13-12(8-17(2)3)10-6-5-9(15)7-11(10)14(18)16-13/h5-7H,4,8H2,1-3H3,(H,16,18)