sodium [3-(2-azanyl-2-oxidanylidene-ethyl)phenyl] [3,5-dimethyl-4-(phenylcarbonyl)phenyl] phosphate

Systemtic Name: sodium [3-(2-azanyl-2-oxidanylidene-ethyl)phenyl] [3,5-dimethyl-4-(phenylcarbonyl)phenyl] phosphate Openeye Name: sodium [3-(2-amino-2-oxo-ethyl)phenyl] (4-benzoyl-3,5-dimethyl-phenyl) phosphate CAS Name: sodium [3-(2-amino-2-oxoethyl)phenyl] (4-benzoyl-3,5-dimethylphenyl) phosphate IUPAC Name: sodium [3-(2-amino-2-oxoethyl)phenyl] (4-benzoyl-3,5-dimethylphenyl) phosphate Traditional Name: sodium [3-(2-amino-2-keto-ethyl)phenyl] (4-benzoyl-3,5-dimethyl-phenyl) phosphate Formula: C23H21NNaO6P MolecularWeight: 461.379471

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C(=O)C2=CC=CC=C2)C)OP(=O)([O-])OC3=CC=CC(=C3)CC(=O)N.[Na+]

Isomeric SMILES

CC1=CC(=CC(=C1C(=O)C2=CC=CC=C2)C)OP(=O)([O-])OC3=CC=CC(=C3)CC(=O)N.[Na+]

InChI

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