sodium [4-[2-(4-methoxyphenyl)ethanoyl]phenyl] (2-methylphenyl) oxidanyl phosphate

Systemtic Name: sodium [4-[2-(4-methoxyphenyl)ethanoyl]phenyl] (2-methylphenyl) oxidanyl phosphate Openeye Name: sodium hydroxy [4-[2-(4-methoxyphenyl)acetyl]phenyl] o-tolyl phosphate CAS Name: sodium phosphoric acid hydroxy [4-[2-(4-methoxyphenyl)-1-oxoethyl]phenyl] (2-methylphenyl) ester IUPAC Name: sodium hydroxy [4-[2-(4-methoxyphenyl)acetyl]phenyl] (2-methylphenyl) phosphate Traditional Name: sodium phosphoric acid hydroxy [4-[2-(4-methoxyphenyl)acetyl]phenyl] o-tolyl ester Formula: C22H21NaO7P+ MolecularWeight: 451.361471

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OP(=O)(OC2=CC=C(C=C2)C(=O)CC3=CC=C(C=C3)OC)OO.[Na+]

Isomeric SMILES

CC1=CC=CC=C1OP(=O)(OC2=CC=C(C=C2)C(=O)CC3=CC=C(C=C3)OC)OO.[Na+]

InChI

InChI=1S/C22H21O7P.Na/c1-16-5-3-4-6-22(16)28-30(25,29-24)27-20-13-9-18(10-14-20)21(23)15-17-7-11-19(26-2)12-8-17;/h3-14,24H,15H2,1-2H3;/q;+1