4-[4-[4-[(E)-but-2-en-2-yl]phenyl]-4-methyl-pentyl]-1-fluoranyl-2-phenoxy-benzene

Systemtic Name: 4-[4-[4-[(E)-but-2-en-2-yl]phenyl]-4-methyl-pentyl]-1-fluoranyl-2-phenoxy-benzene Openeye Name: 1-fluoro-4-[4-methyl-4-[4-[(E)-1-methylprop-1-enyl]phenyl]pentyl]-2-phenoxy-benzene CAS Name: 4-[4-[4-[(E)-but-2-en-2-yl]phenyl]-4-methylpentyl]-1-fluoro-2-phenoxybenzene IUPAC Name: 4-[4-[4-[(E)-but-2-en-2-yl]phenyl]-4-methylpentyl]-1-fluoro-2-phenoxybenzene Traditional Name: 1-fluoro-4-[4-methyl-4-[4-[(E)-1-methylprop-1-enyl]phenyl]pentyl]-2-phenoxy-benzene Formula: C28H31FO MolecularWeight: 402.543543

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)C1=CC=C(C=C1)C(C)(C)CCCC2=CC(=C(C=C2)F)OC3=CC=CC=C3

Isomeric SMILES

C/C=C(\C)/C1=CC=C(C=C1)C(C)(C)CCCC2=CC(=C(C=C2)F)OC3=CC=CC=C3

InChI

InChI=1S/C28H31FO/c1-5-21(2)23-14-16-24(17-15-23)28(3,4)19-9-10-22-13-18-26(29)27(20-22)30-25-11-7-6-8-12-25/h5-8,11-18,20H,9-10,19H2,1-4H3/b21-5+