sodium phenyl [3-[3-(4-propan-2-ylphenyl)propanoyl]phenyl] phosphate

Systemtic Name: sodium phenyl [3-[3-(4-propan-2-ylphenyl)propanoyl]phenyl] phosphate Openeye Name: sodium [3-[3-(4-isopropylphenyl)propanoyl]phenyl] phenyl phosphate CAS Name: sodium [3-[1-oxo-3-(4-propan-2-ylphenyl)propyl]phenyl] phenyl phosphate IUPAC Name: sodium phenyl [3-[3-(4-propan-2-ylphenyl)propanoyl]phenyl] phosphate Traditional Name: sodium [3-(3-p-cumenylpropanoyl)phenyl] phenyl phosphate Formula: C24H24NaO5P MolecularWeight: 446.407891

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H25O5P.Na/c1-18(2)20-14-11-19(12-15-20)13-16-24(25)21-7-6-10-23(17-21)29-30(26,27)28-22-8-4-3-5-9-22;/h3-12,14-15,17-18H,13,16H2,1-2H3,(H,26,27);/q;+1/p-1