sodium [4-[2-(4-methoxy-3,5-dimethyl-phenyl)ethyl]-2-methyl-phenyl] methyl phenyl phosphate

Systemtic Name: sodium [4-[2-(4-methoxy-3,5-dimethyl-phenyl)ethyl]-2-methyl-phenyl] methyl phenyl phosphate Openeye Name: sodium [4-[2-(4-methoxy-3,5-dimethyl-phenyl)ethyl]-2-methyl-phenyl] methyl phenyl phosphate CAS Name: sodium phosphoric acid [4-[2-(4-methoxy-3,5-dimethylphenyl)ethyl]-2-methylphenyl] methyl phenyl ester IUPAC Name: sodium [4-[2-(4-methoxy-3,5-dimethylphenyl)ethyl]-2-methylphenyl] methyl phenyl phosphate Traditional Name: sodium phosphoric acid [4-[2-(4-methoxy-3,5-dimethyl-phenyl)ethyl]-2-methyl-phenyl] methyl phenyl ester Formula: C25H29NaO5P+ MolecularWeight: 463.458291

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC)C)CCC2=CC(=C(C=C2)OP(=O)(OC)OC3=CC=CC=C3)C.[Na+]

Isomeric SMILES

CC1=CC(=CC(=C1OC)C)CCC2=CC(=C(C=C2)OP(=O)(OC)OC3=CC=CC=C3)C.[Na+]

InChI

InChI=1S/C25H29O5P.Na/c1-18-15-21(11-12-22-16-19(2)25(27-4)20(3)17-22)13-14-24(18)30-31(26,28-5)29-23-9-7-6-8-10-23;/h6-10,13-17H,11-12H2,1-5H3;/q;+1