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[4-(4-acetyloxyphenyl)phenyl] ethanoate hydrate

[4-(4-acetyloxyphenyl)phenyl] ethanoate hydrate

Systemtic Name:[4-(4-acetyloxyphenyl)phenyl] ethanoate hydrate
Openeye Name:[4-(4-acetoxyphenyl)phenyl] acetate hydrate
CAS Name:acetic acid [4-(4-acetyloxyphenyl)phenyl] ester hydrate
IUPAC Name:[4-(4-acetyloxyphenyl)phenyl] acetate hydrate
Traditional Name:acetic acid [4-(4-acetoxyphenyl)phenyl] ester hydrate
Formula: C32H30O9
MolecularWeight: 558.5752
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C.CC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C.O


Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C.CC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C.O


InChI

InChI=1S/2C16H14O4.H2O/c2*1-11(17)19-15-7-3-13(4-8-15)14-5-9-16(10-6-14)20-12(2)18;/h2*3-10H,1-2H3;1H2


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