(4-cyanophenyl) 1,3-bis(fluoranyl)-7-propyl-9,10-dihydrophenanthrene-2-carboxylate

Systemtic Name: (4-cyanophenyl) 1,3-bis(fluoranyl)-7-propyl-9,10-dihydrophenanthrene-2-carboxylate Openeye Name: (4-cyanophenyl) 1,3-difluoro-7-propyl-9,10-dihydrophenanthrene-2-carboxylate CAS Name: 1,3-difluoro-7-propyl-9,10-dihydrophenanthrene-2-carboxylic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 1,3-difluoro-7-propyl-9,10-dihydrophenanthrene-2-carboxylate Traditional Name: 1,3-difluoro-7-propyl-9,10-dihydrophenanthrene-2-carboxylic acid (4-cyanophenyl) ester Formula: C25H19F2NO2 MolecularWeight: 403.420666

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=C(C=C1)C3=CC(=C(C(=C3CC2)F)C(=O)OC4=CC=C(C=C4)C#N)F

Isomeric SMILES

CCCC1=CC2=C(C=C1)C3=CC(=C(C(=C3CC2)F)C(=O)OC4=CC=C(C=C4)C#N)F

InChI

InChI=1S/C25H19F2NO2/c1-2-3-15-6-10-19-17(12-15)7-11-20-21(19)13-22(26)23(24(20)27)25(29)30-18-8-4-16(14-28)5-9-18/h4-6,8-10,12-13H,2-3,7,11H2,1H3