1-[7-bromanyl-3-[(4-fluorophenyl)methoxy]naphthalen-2-yl]adamantane

Systemtic Name: 1-[7-bromanyl-3-[(4-fluorophenyl)methoxy]naphthalen-2-yl]adamantane Openeye Name: 1-[7-bromo-3-[(4-fluorophenyl)methoxy]-2-naphthyl]adamantane CAS Name: 1-[7-bromo-3-[(4-fluorophenyl)methoxy]-2-naphthalenyl]adamantane IUPAC Name: 1-[7-bromo-3-[(4-fluorophenyl)methoxy]naphthalen-2-yl]adamantane Traditional Name: 1-[7-bromo-3-(4-fluorobenzyl)oxy-2-naphthyl]adamantane Formula: C27H26BrFO MolecularWeight: 465.397143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=C(C=C5C=CC(=CC5=C4)Br)OCC6=CC=C(C=C6)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=C(C=C5C=CC(=CC5=C4)Br)OCC6=CC=C(C=C6)F

InChI

InChI=1S/C27H26BrFO/c28-23-4-3-21-12-26(30-16-17-1-5-24(29)6-2-17)25(11-22(21)10-23)27-13-18-7-19(14-27)9-20(8-18)15-27/h1-6,10-12,18-20H,7-9,13-16H2