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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C(=O)CCC2=CC=C(C=C2)OP(=O)([O-])OC3=CC=CC=C3.[Na+]

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C(=O)CCC2=CC=C(C=C2)OP(=O)([O-])OC3=CC=CC=C3.[Na+]

InChI

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