(E)-2-methyldodec-3-ene; triphenylphosphanium; bromide

Systemtic Name: (E)-2-methyldodec-3-ene; triphenylphosphanium; bromide Openeye Name: (E)-2-methyldodec-3-ene; triphenylphosphonium; bromide CAS Name: (E)-2-methyl-3-dodecene; triphenylphosphonium; bromide IUPAC Name: (E)-2-methyldodec-3-ene; triphenylphosphanium; bromide Traditional Name: (E)-2-methyldodec-3-ene; triphenylphosphonium; bromide Formula: C31H42BrP MolecularWeight: 525.542941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CC(C)C.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

Isomeric SMILES

CCCCCCCC/C=C/C(C)C.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C18H15P.C13H26.BrH/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-4-5-6-7-8-9-10-11-12-13(2)3;/h1-15H;11-13H,4-10H2,1-3H3;1H/b;12-11+;