[3,6-bis(oxidanylidene)-2-phenyl-cyclohexa-1,4-dien-1-yl] nonyl phenyl phosphate

Systemtic Name: [3,6-bis(oxidanylidene)-2-phenyl-cyclohexa-1,4-dien-1-yl] nonyl phenyl phosphate Openeye Name: (3,6-dioxo-2-phenyl-cyclohexa-1,4-dien-1-yl) nonyl phenyl phosphate CAS Name: phosphoric acid (3,6-dioxo-2-phenyl-1-cyclohexa-1,4-dienyl) nonyl phenyl ester IUPAC Name: (3,6-dioxo-2-phenylcyclohexa-1,4-dien-1-yl) nonyl phenyl phosphate Traditional Name: phosphoric acid (3,6-diketo-2-phenyl-cyclohexa-1,4-dien-1-yl) nonyl phenyl ester Formula: C27H31O6P MolecularWeight: 482.505201

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOP(=O)(OC1=CC=CC=C1)OC2=C(C(=O)C=CC2=O)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCOP(=O)(OC1=CC=CC=C1)OC2=C(C(=O)C=CC2=O)C3=CC=CC=C3

InChI

InChI=1S/C27H31O6P/c1-2-3-4-5-6-7-14-21-31-34(30,32-23-17-12-9-13-18-23)33-27-25(29)20-19-24(28)26(27)22-15-10-8-11-16-22/h8-13,15-20H,2-7,14,21H2,1H3