1-chloranyl-4-[2-fluoranyl-2-methyl-6-(3-phenoxyphenyl)hexan-3-yl]benzene

Systemtic Name: 1-chloranyl-4-[2-fluoranyl-2-methyl-6-(3-phenoxyphenyl)hexan-3-yl]benzene Openeye Name: 1-chloro-4-[1-(1-fluoro-1-methyl-ethyl)-4-(3-phenoxyphenyl)butyl]benzene CAS Name: 1-chloro-4-[2-fluoro-2-methyl-6-(3-phenoxyphenyl)hexan-3-yl]benzene IUPAC Name: 1-chloro-4-[2-fluoro-2-methyl-6-(3-phenoxyphenyl)hexan-3-yl]benzene Traditional Name: 1-chloro-4-[1-(1-fluoro-1-methyl-ethyl)-4-(3-phenoxyphenyl)butyl]benzene Formula: C25H26ClFO MolecularWeight: 396.924743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(CCCC1=CC(=CC=C1)OC2=CC=CC=C2)C3=CC=C(C=C3)Cl)F

Isomeric SMILES

CC(C)(C(CCCC1=CC(=CC=C1)OC2=CC=CC=C2)C3=CC=C(C=C3)Cl)F

InChI

InChI=1S/C25H26ClFO/c1-25(2,27)24(20-14-16-21(26)17-15-20)13-7-9-19-8-6-12-23(18-19)28-22-10-4-3-5-11-22/h3-6,8,10-12,14-18,24H,7,9,13H2,1-2H3