2-[2,4-bis(fluoranyl)phenyl]-4-piperidin-1-ylcarbonyl-isoquinolin-1-one

Systemtic Name: 2-[2,4-bis(fluoranyl)phenyl]-4-piperidin-1-ylcarbonyl-isoquinolin-1-one Openeye Name: 2-(2,4-difluorophenyl)-4-(piperidine-1-carbonyl)isoquinolin-1-one CAS Name: 2-(2,4-difluorophenyl)-4-[oxo(1-piperidinyl)methyl]-1-isoquinolinone IUPAC Name: 2-(2,4-difluorophenyl)-4-(piperidine-1-carbonyl)isoquinolin-1-one Traditional Name: 2-(2,4-difluorophenyl)-4-(piperidine-1-carbonyl)isocarbostyril Formula: C21H18F2N2O2 MolecularWeight: 368.376626

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=C(C=C(C=C4)F)F

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=C(C=C(C=C4)F)F

InChI

InChI=1S/C21H18F2N2O2/c22-14-8-9-19(18(23)12-14)25-13-17(20(26)24-10-4-1-5-11-24)15-6-2-3-7-16(15)21(25)27/h2-3,6-9,12-13H,1,4-5,10-11H2