4-(3-fluorophenyl)-6-methoxy-2-methyl-3-pyrrolidin-1-ylcarbonyl-isoquinolin-1-one

Systemtic Name: 4-(3-fluorophenyl)-6-methoxy-2-methyl-3-pyrrolidin-1-ylcarbonyl-isoquinolin-1-one Openeye Name: 4-(3-fluorophenyl)-6-methoxy-2-methyl-3-(pyrrolidine-1-carbonyl)isoquinolin-1-one CAS Name: 4-(3-fluorophenyl)-6-methoxy-2-methyl-3-[oxo(1-pyrrolidinyl)methyl]-1-isoquinolinone IUPAC Name: 4-(3-fluorophenyl)-6-methoxy-2-methyl-3-(pyrrolidine-1-carbonyl)isoquinolin-1-one Traditional Name: 4-(3-fluorophenyl)-6-methoxy-2-methyl-3-(pyrrolidine-1-carbonyl)isocarbostyril Formula: C22H21FN2O3 MolecularWeight: 380.412143

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C(C1=O)C=CC(=C2)OC)C3=CC(=CC=C3)F)C(=O)N4CCCC4

Isomeric SMILES

CN1C(=C(C2=C(C1=O)C=CC(=C2)OC)C3=CC(=CC=C3)F)C(=O)N4CCCC4

InChI

InChI=1S/C22H21FN2O3/c1-24-20(22(27)25-10-3-4-11-25)19(14-6-5-7-15(23)12-14)18-13-16(28-2)8-9-17(18)21(24)26/h5-9,12-13H,3-4,10-11H2,1-2H3