heptyl(triphenyl)phosphanium; N-methylmethanamide; bromide

Systemtic Name: heptyl(triphenyl)phosphanium; N-methylmethanamide; bromide Openeye Name: heptyl(triphenyl)phosphonium; N-methylformamide; bromide CAS Name: heptyl(triphenyl)phosphonium; N-methylformamide; bromide IUPAC Name: heptyl(triphenyl)phosphanium; N-methylformamide; bromide Traditional Name: heptyl(triphenyl)phosphonium; N-methylformamide; bromide Formula: C27H35BrNOP MolecularWeight: 500.450661

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.CNC=O.[Br-]

Isomeric SMILES

CCCCCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.CNC=O.[Br-]

InChI

InChI=1S/C25H30P.C2H5NO.BrH/c1-2-3-4-5-15-22-26(23-16-9-6-10-17-23,24-18-11-7-12-19-24)25-20-13-8-14-21-25;1-3-2-4;/h6-14,16-21H,2-5,15,22H2,1H3;2H,1H3,(H,3,4);1H/q+1;;/p-1