benzo[a]anthracen-1-yloxy-bis(oxidanidyl)borane; hexadecyl(triphenyl)phosphanium

Systemtic Name: benzo[a]anthracen-1-yloxy-bis(oxidanidyl)borane; hexadecyl(triphenyl)phosphanium Openeye Name: benzo[a]anthracen-1-yloxy(dioxido)borane; hexadecyl(triphenyl)phosphonium CAS Name: 1-benzo[a]anthracenyloxy(dioxido)borane; hexadecyl(triphenyl)phosphonium IUPAC Name: benzo[a]anthracen-1-yloxy(dioxido)borane; hexadecyl(triphenyl)phosphanium Traditional Name: benz[a]anthracen-1-yloxy(dioxido)borane; cetyl(triphenyl)phosphonium Formula: C52H59BO3P- MolecularWeight: 773.807821

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B([O-])([O-])OC1=CC=CC2=C1C3=CC4=CC=CC=C4C=C3C=C2.CCCCCCCCCCCCCCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

B([O-])([O-])OC1=CC=CC2=C1C3=CC4=CC=CC=C4C=C3C=C2.CCCCCCCCCCCCCCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C34H48P.C18H11BO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-24-31-35(32-25-18-15-19-26-32,33-27-20-16-21-28-33)34-29-22-17-23-30-34;20-19(21)22-17-7-3-6-12-8-9-15-10-13-4-1-2-5-14(13)11-16(15)18(12)17/h15-23,25-30H,2-14,24,31H2,1H3;1-11H/q+1;-2