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benzoate tetrahydrate

benzoate tetrahydrate

Systemtic Name:benzoate tetrahydrate
Openeye Name:benzoate tetrahydrate
CAS Name:benzoate tetrahydrate
IUPAC Name:benzoate tetrahydrate
Traditional Name:benzoate tetrahydrate
Formula: C7H13O6-
MolecularWeight: 193.17452
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)[O-].O.O.O.O


Isomeric SMILES

C1=CC=C(C=C1)C(=O)[O-].O.O.O.O


InChI

InChI=1S/C7H6O2.4H2O/c8-7(9)6-4-2-1-3-5-6;;;;/h1-5H,(H,8,9);4*1H2/p-1


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