2-[(2R,4aR)-6-heptyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl]-6-[(E)-but-2-enoxy]-1,7-bis(fluoranyl)naphthalene

Systemtic Name: 2-[(2R,4aR)-6-heptyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl]-6-[(E)-but-2-enoxy]-1,7-bis(fluoranyl)naphthalene Openeye Name: 2-[(2R,4aR)-6-heptyldecalin-2-yl]-6-[(E)-but-2-enoxy]-1,7-difluoro-naphthalene CAS Name: 2-[(2R,4aR)-6-heptyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl]-6-[(E)-but-2-enoxy]-1,7-difluoronaphthalene IUPAC Name: 2-[(2R,4aR)-6-heptyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl]-6-[(E)-but-2-enoxy]-1,7-difluoronaphthalene Traditional Name: 2-[(2R,4aR)-6-heptyldecalin-2-yl]-6-[(E)-but-2-enoxy]-1,7-difluoro-naphthalene Formula: C31H42F2O MolecularWeight: 468.661386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC2CC(CCC2C1)C3=C(C4=CC(=C(C=C4C=C3)OCC=CC)F)F

Isomeric SMILES

CCCCCCCC1CCC2C[C@@H](CC[C@@H]2C1)C3=C(C4=CC(=C(C=C4C=C3)OC/C=C/C)F)F

InChI

InChI=1S/C31H42F2O/c1-3-5-7-8-9-10-22-11-12-24-19-25(14-13-23(24)18-22)27-16-15-26-20-30(34-17-6-4-2)29(32)21-28(26)31(27)33/h4,6,15-16,20-25H,3,5,7-14,17-19H2,1-2H3/b6-4+/t22?,23-,24?,25-/m1/s1