[8,9-di(octanoyloxy)-10-phenyl-anthracen-1-yl] octanoate

Systemtic Name: [8,9-di(octanoyloxy)-10-phenyl-anthracen-1-yl] octanoate Openeye Name: [8,9-di(octanoyloxy)-10-phenyl-1-anthryl] octanoate CAS Name: octanoic acid [8,9-bis(1-oxooctoxy)-10-phenyl-1-anthracenyl] ester IUPAC Name: [8,9-di(octanoyloxy)-10-phenylanthracen-1-yl] octanoate Traditional Name: caprylic acid (8,9-dicaprylyloxy-10-phenyl-1-anthryl) ester Formula: C44H56O6 MolecularWeight: 680.91184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC1=CC=CC2=C1C(=C3C(=C2C4=CC=CC=C4)C=CC=C3OC(=O)CCCCCCC)OC(=O)CCCCCCC

Isomeric SMILES

CCCCCCCC(=O)OC1=CC=CC2=C1C(=C3C(=C2C4=CC=CC=C4)C=CC=C3OC(=O)CCCCCCC)OC(=O)CCCCCCC

InChI

InChI=1S/C44H56O6/c1-4-7-10-13-19-30-38(45)48-36-28-22-26-34-41(33-24-17-16-18-25-33)35-27-23-29-37(49-39(46)31-20-14-11-8-5-2)43(35)44(42(34)36)50-40(47)32-21-15-12-9-6-3/h16-18,22-29H,4-15,19-21,30-32H2,1-3H3