sodium (4-tert-butylcyclohexyl) [4-(2,4,6-trimethoxyphenyl)carbonylphenyl] phosphate

Systemtic Name: sodium (4-tert-butylcyclohexyl) [4-(2,4,6-trimethoxyphenyl)carbonylphenyl] phosphate Openeye Name: sodium (4-tert-butylcyclohexyl) [4-(2,4,6-trimethoxybenzoyl)phenyl] phosphate CAS Name: sodium (4-tert-butylcyclohexyl) [4-[oxo-(2,4,6-trimethoxyphenyl)methyl]phenyl] phosphate IUPAC Name: sodium (4-tert-butylcyclohexyl) [4-(2,4,6-trimethoxybenzoyl)phenyl] phosphate Traditional Name: sodium (4-tert-butylcyclohexyl) [4-(2,4,6-trimethoxybenzoyl)phenyl] phosphate Formula: C26H34NaO8P MolecularWeight: 528.506891

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)OP(=O)([O-])OC2=CC=C(C=C2)C(=O)C3=C(C=C(C=C3OC)OC)OC.[Na+]

Isomeric SMILES

CC(C)(C)C1CCC(CC1)OP(=O)([O-])OC2=CC=C(C=C2)C(=O)C3=C(C=C(C=C3OC)OC)OC.[Na+]

InChI

InChI=1S/C26H35O8P.Na/c1-26(2,3)18-9-13-20(14-10-18)34-35(28,29)33-19-11-7-17(8-12-19)25(27)24-22(31-5)15-21(30-4)16-23(24)32-6;/h7-8,11-12,15-16,18,20H,9-10,13-14H2,1-6H3,(H,28,29);/q;+1/p-1