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

Systemtic Name: sodium [4-(3-oxidanylidene-3-phenyl-propyl)phenyl] (2-propan-2-ylphenyl) phosphate Openeye Name: sodium (2-isopropylphenyl) [4-(3-oxo-3-phenyl-propyl)phenyl] phosphate CAS Name: sodium [4-(3-oxo-3-phenylpropyl)phenyl] (2-propan-2-ylphenyl) phosphate IUPAC Name: sodium [4-(3-oxo-3-phenylpropyl)phenyl] (2-propan-2-ylphenyl) phosphate Traditional Name: sodium [4-(3-keto-3-phenyl-propyl)phenyl] o-cumenyl phosphate Formula: C24H24NaO5P MolecularWeight: 446.407891

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OP(=O)([O-])OC2=CC=C(C=C2)CCC(=O)C3=CC=CC=C3.[Na+]

Isomeric SMILES

CC(C)C1=CC=CC=C1OP(=O)([O-])OC2=CC=C(C=C2)CCC(=O)C3=CC=CC=C3.[Na+]

InChI

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