3-(4-pentanoylphenyl)propyl dihydrogen phosphate

Systemtic Name: 3-(4-pentanoylphenyl)propyl dihydrogen phosphate Openeye Name: 3-(4-pentanoylphenyl)propyl dihydrogen phosphate CAS Name: 3-[4-(1-oxopentyl)phenyl]propyl dihydrogen phosphate IUPAC Name: 3-(4-pentanoylphenyl)propyl dihydrogen phosphate Traditional Name: 3-(4-valerylphenyl)propyl dihydrogen phosphate Formula: C14H21O5P MolecularWeight: 300.287301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1=CC=C(C=C1)CCCOP(=O)(O)O

Isomeric SMILES

CCCCC(=O)C1=CC=C(C=C1)CCCOP(=O)(O)O

InChI

InChI=1S/C14H21O5P/c1-2-3-6-14(15)13-9-7-12(8-10-13)5-4-11-19-20(16,17)18/h7-10H,2-6,11H2,1H3,(H2,16,17,18)