3-[2-[2-(ethoxymethyl)pyrrolidin-1-yl]ethyl]-5-fluoranyl-2H-isoquinolin-1-one

Systemtic Name: 3-[2-[2-(ethoxymethyl)pyrrolidin-1-yl]ethyl]-5-fluoranyl-2H-isoquinolin-1-one Openeye Name: 3-[2-[2-(ethoxymethyl)pyrrolidin-1-yl]ethyl]-5-fluoro-2H-isoquinolin-1-one CAS Name: 3-[2-[2-(ethoxymethyl)-1-pyrrolidinyl]ethyl]-5-fluoro-2H-isoquinolin-1-one IUPAC Name: 3-[2-[2-(ethoxymethyl)pyrrolidin-1-yl]ethyl]-5-fluoro-2H-isoquinolin-1-one Traditional Name: 3-[2-[2-(ethoxymethyl)pyrrolidino]ethyl]-5-fluoro-isocarbostyril Formula: C18H23FN2O2 MolecularWeight: 318.385823

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1CCCN1CCC2=CC3=C(C=CC=C3F)C(=O)N2

Isomeric SMILES

CCOCC1CCCN1CCC2=CC3=C(C=CC=C3F)C(=O)N2

InChI

InChI=1S/C18H23FN2O2/c1-2-23-12-14-5-4-9-21(14)10-8-13-11-16-15(18(22)20-13)6-3-7-17(16)19/h3,6-7,11,14H,2,4-5,8-10,12H2,1H3,(H,20,22)