5',6'-bis(fluoranyl)-2-pentyl-spiro[1H-isoquinoline-4,3'-2H-1-benzofuran]-3-one

Systemtic Name: 5',6'-bis(fluoranyl)-2-pentyl-spiro[1H-isoquinoline-4,3'-2H-1-benzofuran]-3-one Openeye Name: 5',6'-difluoro-2-pentyl-spiro[1H-isoquinoline-4,3'-2H-benzofuran]-3-one CAS Name: 5',6'-difluoro-2-pentyl-3-spiro[1H-isoquinoline-4,3'-2H-benzofuran]one IUPAC Name: 5',6'-difluoro-2-pentylspiro[1H-isoquinoline-4,3'-2H-1-benzofuran]-3-one Traditional Name: 2-amyl-5',6'-difluoro-spiro[1H-isoquinoline-4,3'-coumaran]-3-one Formula: C21H21F2NO2 MolecularWeight: 357.393746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1CC2=CC=CC=C2C3(C1=O)COC4=CC(=C(C=C34)F)F

Isomeric SMILES

CCCCCN1CC2=CC=CC=C2C3(C1=O)COC4=CC(=C(C=C34)F)F

InChI

InChI=1S/C21H21F2NO2/c1-2-3-6-9-24-12-14-7-4-5-8-15(14)21(20(24)25)13-26-19-11-18(23)17(22)10-16(19)21/h4-5,7-8,10-11H,2-3,6,9,12-13H2,1H3