sodium (3-acetamidophenyl) [4-(3-oxidanylidene-3-phenyl-propyl)phenyl] phosphate

Systemtic Name: sodium (3-acetamidophenyl) [4-(3-oxidanylidene-3-phenyl-propyl)phenyl] phosphate Openeye Name: sodium (3-acetamidophenyl) [4-(3-oxo-3-phenyl-propyl)phenyl] phosphate CAS Name: sodium (3-acetamidophenyl) [4-(3-oxo-3-phenylpropyl)phenyl] phosphate IUPAC Name: sodium (3-acetamidophenyl) [4-(3-oxo-3-phenylpropyl)phenyl] phosphate Traditional Name: sodium (3-acetamidophenyl) [4-(3-keto-3-phenyl-propyl)phenyl] phosphate Formula: C23H21NNaO6P MolecularWeight: 461.379471

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)OP(=O)([O-])OC2=CC=C(C=C2)CCC(=O)C3=CC=CC=C3.[Na+]

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)OP(=O)([O-])OC2=CC=C(C=C2)CCC(=O)C3=CC=CC=C3.[Na+]

InChI

InChI=1S/C23H22NO6P.Na/c1-17(25)24-20-8-5-9-22(16-20)30-31(27,28)29-21-13-10-18(11-14-21)12-15-23(26)19-6-3-2-4-7-19;/h2-11,13-14,16H,12,15H2,1H3,(H,24,25)(H,27,28);/q;+1/p-1