sodium [4-[(Z)-2-cyclohexyl-2-phenyl-ethenyl]phenyl] (2-methylphenyl) phosphate

Systemtic Name: sodium [4-[(Z)-2-cyclohexyl-2-phenyl-ethenyl]phenyl] (2-methylphenyl) phosphate Openeye Name: sodium [4-[(Z)-2-cyclohexyl-2-phenyl-vinyl]phenyl] o-tolyl phosphate CAS Name: sodium [4-[(Z)-2-cyclohexyl-2-phenylethenyl]phenyl] (2-methylphenyl) phosphate IUPAC Name: sodium [4-[(Z)-2-cyclohexyl-2-phenylethenyl]phenyl] (2-methylphenyl) phosphate Traditional Name: sodium [4-[(Z)-2-cyclohexyl-2-phenyl-vinyl]phenyl] o-tolyl phosphate Formula: C27H28NaO4P MolecularWeight: 470.472351

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OP(=O)([O-])OC2=CC=C(C=C2)C=C(C3CCCCC3)C4=CC=CC=C4.[Na+]

Isomeric SMILES

CC1=CC=CC=C1OP(=O)([O-])OC2=CC=C(C=C2)/C=C(/C3CCCCC3)\C4=CC=CC=C4.[Na+]

InChI

InChI=1S/C27H29O4P.Na/c1-21-10-8-9-15-27(21)31-32(28,29)30-25-18-16-22(17-19-25)20-26(23-11-4-2-5-12-23)24-13-6-3-7-14-24;/h2,4-5,8-12,15-20,24H,3,6-7,13-14H2,1H3,(H,28,29);/q;+1/p-1/b26-20+;