sodium acetamidomethyl (2-methylphenyl) [4-(phenylcarbonyl)phenyl] phosphate

Systemtic Name: sodium acetamidomethyl (2-methylphenyl) [4-(phenylcarbonyl)phenyl] phosphate Openeye Name: sodium acetamidomethyl (4-benzoylphenyl) o-tolyl phosphate CAS Name: sodium phosphoric acid acetamidomethyl (4-benzoylphenyl) (2-methylphenyl) ester IUPAC Name: sodium acetamidomethyl (4-benzoylphenyl) (2-methylphenyl) phosphate Traditional Name: sodium phosphoric acid acetamidomethyl (4-benzoylphenyl) o-tolyl ester Formula: C23H22NNaO6P+ MolecularWeight: 462.387411

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22NO6P.Na/c1-17-8-6-7-11-22(17)30-31(27,28-16-24-18(2)25)29-21-14-12-20(13-15-21)23(26)19-9-4-3-5-10-19;/h3-15H,16H2,1-2H3,(H,24,25);/q;+1