[4-(4-phosphonooxyphenyl)carbonylphenyl] hexanoate

Systemtic Name: [4-(4-phosphonooxyphenyl)carbonylphenyl] hexanoate Openeye Name: [4-(4-phosphonooxybenzoyl)phenyl] hexanoate CAS Name: hexanoic acid [4-[oxo-(4-phosphonooxyphenyl)methyl]phenyl] ester IUPAC Name: [4-(4-phosphonooxybenzoyl)phenyl] hexanoate Traditional Name: hexanoic acid [4-(4-phosphonooxybenzoyl)phenyl] ester Formula: C19H21O7P MolecularWeight: 392.339601

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OP(=O)(O)O

Isomeric SMILES

CCCCCC(=O)OC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OP(=O)(O)O

InChI

InChI=1S/C19H21O7P/c1-2-3-4-5-18(20)25-16-10-6-14(7-11-16)19(21)15-8-12-17(13-9-15)26-27(22,23)24/h6-13H,2-5H2,1H3,(H2,22,23,24)